Phenyltetrazoles and derivatives

Description:

Compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Azoles ⮕ Tetrazoles ⮕ Phenyltetrazoles and derivatives

5-[4-(Trifluoromethyl)phenyl]-1H-tetrazole
- ≥98%
Cas Number: 2251-79-8 Compound CID: 342565

Formula: C₈H₅F₃N₄ Molecular Weight: 214.15

IUPAC Name: 5-[4-(trifluoromethyl)phenyl]-2H-tetrazole

SMILES: C1=CC(=CC=C1C2=NNN=N2)C(F)(F)F

InChIKey: CCVCHQBLMDMSNN-UHFFFAOYSA-N

InChI: InChI=1S/C8H5F3N4/c9-8(10,11)6-3-1-5(2-4-6)7-12-14-15-13-7/h1-4H,(H,12,13,14,15)
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5-(m-Tolyl)-1H-tetrazole
- ≥98%
Cas Number: 3441-00-7 Compound CID: 583308

Formula: C₈H₈N₄ Molecular Weight: 160.18

IUPAC Name: 5-(3-methylphenyl)-2H-tetrazole

SMILES: CC1=CC(=CC=C1)C2=NNN=N2

InChIKey: GWZNHKMUSLKULV-UHFFFAOYSA-N

InChI: InChI=1S/C8H8N4/c1-6-3-2-4-7(5-6)8-9-11-12-10-8/h2-5H,1H3,(H,9,10,11,12)
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2-(5-phenyl-2H-1，2，3，4-tetraazol-2-yl)acetohydrazide
- ≥95%
Cas Number: 67037-01-8 Compound CID: 702170

Formula: C₉H₁₀N₆O Molecular Weight: 218.22

IUPAC Name: 2-(5-phenyltetrazol-2-yl)acetohydrazide

SMILES: C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NN

InChIKey: WCWGCMVQLJYKCB-UHFFFAOYSA-N

InChI: InChI=1S/C9H10N6O/c10-11-8(16)6-15-13-9(12-14-15)7-4-2-1-3-5-7/h1-5H,6,10H2,(H,11,16)
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1-Phenyl-1H-tetrazole
- ≥97%
Cas Number: 5378-52-9 Compound CID: 138477

Formula: C₇H₆N₄ Molecular Weight: 146.15

IUPAC Name: 1-phenyltetrazole

SMILES: C1=CC=C(C=C1)N2C=NN=N2

InChIKey: IYPXPGSELZFFMI-UHFFFAOYSA-N

InChI: InChI=1S/C7H6N4/c1-2-4-7(5-3-1)11-6-8-9-10-11/h1-6H
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Dasolampanel
Cas Number: 503294-13-1

Formula: C₁₇H₂₀ClN₅O₃ Molecular Weight: 377.8

IUPAC Name: (3S,4aS,6S,8aR)-6-[3-chloro-2-(2H-tetrazol-5-yl)phenoxy]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid

SMILES: C1CC2CNC(CC2CC1OC3=C(C(=CC=C3)Cl)C4=NNN=N4)C(=O)O

InChIKey: LAKQPSQCICNZII-NOHGZBONSA-N

InChI: InChI=1S/C17H20ClN5O3/c18-12-2-1-3-14(15(12)16-20-22-23-21-16)26-11-5-4-9-8-19-13(17(24)25)7-10(9)6-11/h1-3,9-11,13,19H,4-8H2,(H,24,25)(H,20,21,22,23)show more

Synonyms: DASOLAMPANEL | SXI | 3-Isoquinolinecarboxylic acid, 6-(3-chloro-2-(2H-tetrazol-5-yl)phenoxy)decahydro-, (3S,4aS,6S,8a...

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3-(5-Pyridin-2-yl-tetrazol-2-yl)-benzonitrile
Cas Number: 507268-13-5

Formula: C₁₃H₈N₆ Molecular Weight: 248.24

IUPAC Name: 3-(5-pyridin-2-yltetrazol-2-yl)benzonitrile

SMILES: C1=CC=NC(=C1)C2=NN(N=N2)C3=CC=CC(=C3)C#N

InChIKey: OGIBYDWBTRKAOL-UHFFFAOYSA-N

InChI: InChI=1S/C13H8N6/c14-9-10-4-3-5-11(8-10)19-17-13(16-18-19)12-6-1-2-7-15-12/h1-8H

Synonyms: 3-(5-Pyridin-2-yl-tetrazol-2-yl)-benzonitrile | 3-(5-pyridin-2-yltetrazol-2-yl)benzonitrile | 3-(5-(pyridin-2-yl)-2h-...

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TH1834 dihydrochloride
- ≥99%
Cas Number: 2108830-09-5 Compound CID: 91826511

Formula: C₃₃H₄₂Cl₂N₆O₃ Molecular Weight: 641.63

IUPAC Name: 2-[5-[4-[[2-phenylethyl-[4-[4-(pyrrolidin-1-ylmethyl)phenoxy]butyl]amino]methyl]phenyl]tetrazol-2-yl]acetic acid;dihydrochloride

SMILES: C1CCN(C1)CC2=CC=C(C=C2)OCCCCN(CCC3=CC=CC=C3)CC4=CC=C(C=C4)C5=NN(N=N5)CC(=O)O.Cl.Cl

InChIKey: HYXIFSOROZPMMU-UHFFFAOYSA-N

InChI: InChI=1S/C33H40N6O3.2ClH/c40-32(41)26-39-35-33(34-36-39)30-14-10-28(11-15-30)25-38(22-18-27-8-2-1-3-9-27)21-6-7-23-42-31-16-12-29(13-17-31)24-37-19-4-show more
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Acitazanolast
- ≥98%
Cas Number: 114607-46-4 Compound CID: 2006

Formula: C₉H₇N₅O₃ Molecular Weight: 233.18

SMILES: C1=CC(=CC(=C1)NC(=O)C(=O)O)C2=NNN=N2
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Tazanolast
- ≥99%
Cas Number: 82989-25-1 Compound CID: 5380

Formula: C₁₃H₁₅N₅O₃ Molecular Weight: 289.29

IUPAC Name: butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate

SMILES: CCCCOC(=O)C(=O)NC1=CC=CC(=C1)C2=NNN=N2

InChIKey: XQTARQNQIVVBRX-UHFFFAOYSA-N

InChI: InChI=1S/C13H15N5O3/c1-2-3-7-21-13(20)12(19)14-10-6-4-5-9(8-10)11-15-17-18-16-11/h4-6,8H,2-3,7H2,1H3,(H,14,19)(H,15,16,17,18)

Synonyms: Tazanolastum | Butyl 2-((3-(1H-tetrazol-5-yl)phenyl)amino)-2-oxoacetate | Tazanolastum [INN-Latin] | tazanolast | 5-(...
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TH1834
- ≥99%
Cas Number: 2108830-08-4 Compound CID: 91826512

Formula: C₃₃H₄₀N₆O₃ Molecular Weight: 568.71

IUPAC Name: 2-[5-[4-[[2-phenylethyl-[4-[4-(pyrrolidin-1-ylmethyl)phenoxy]butyl]amino]methyl]phenyl]tetrazol-2-yl]acetic acid

SMILES: C1CCN(C1)CC2=CC=C(C=C2)OCCCCN(CCC3=CC=CC=C3)CC4=CC=C(C=C4)C5=NN(N=N5)CC(=O)O

InChIKey: XERATECPNBWJFP-UHFFFAOYSA-N

InChI: InChI=1S/C33H40N6O3/c40-32(41)26-39-35-33(34-36-39)30-14-10-28(11-15-30)25-38(22-18-27-8-2-1-3-9-27)21-6-7-23-42-31-16-12-29(13-17-31)24-37-19-4-5-20-show more
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TES-991
- ≥99%
Cas Number: 1883602-20-7 Compound CID: 137142884

Formula: C₁₇H₁₁N₇OS₂ Molecular Weight: 393.45

IUPAC Name: 6-oxo-2-[[3-(2H-tetrazol-5-yl)phenyl]methylsulfanyl]-4-thiophen-2-yl-1H-pyrimidine-5-carbonitrile

SMILES: C1=CC(=CC(=C1)C2=NNN=N2)CSC3=NC(=C(C(=O)N3)C#N)C4=CC=CS4

InChIKey: VCDQAPTULMMFKX-UHFFFAOYSA-N

InChI: InChI=1S/C17H11N7OS2/c18-8-12-14(13-5-2-6-26-13)19-17(20-16(12)25)27-9-10-3-1-4-11(7-10)15-21-23-24-22-15/h1-7H,9H2,(H,19,20,25)(H,21,22,23,24)
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2-chloro-6-(2H-tetrazol-5-yl)aniline
- ≥97%
Cas Number: 26803-78-1 Compound CID: 20574105

Formula: C₇H₆N₅Cl Molecular Weight: 195.61

IUPAC Name: 2-chloro-6-(2H-tetrazol-5-yl)aniline

SMILES: C1=CC(=C(C(=C1)Cl)N)C2=NNN=N2

InChIKey: QIMDCYFTGCRARW-UHFFFAOYSA-N

InChI: InChI=1S/C7H6ClN5/c8-5-3-1-2-4(6(5)9)7-10-12-13-11-7/h1-3H,9H2,(H,10,11,12,13)

Synonyms: 2-chloro-6-(2H-tetrazol-5-yl)aniline | 26803-78-1 | 2-CHLORO-6-(1H-1,2,3,4-TETRAZOL-5-YL)ANILINE | SCHEMBL1308125 | 5...
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