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Benzamides
Description:
Organic compounds containing a carboxamido substituent attached to a benzene ring.
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Roflumilast Impurity ECas Number: 1391052-76-8 Compound CID: 66777253Formula: C13H8Cl2F2N2O3 Molecular Weight: 349.12IUPAC Name: N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)-3-hydroxybenzamideSMILES: C1=CC(=C(C=C1C(=O)NC2=C(C=NC=C2Cl)Cl)O)OC(F)FInChIKey: GZHTYXYJBZYTEV-UHFFFAOYSA-NInChI: InChI=1S/C13H8Cl2F2N2O3/c14-7-4-18-5-8(15)11(7)19-12(21)6-1-2-10(9(20)3-6)22-13(16)17/h1-5,13,20H,(H,18,19,21)
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(4-(Benzyl(methyl)carbamoyl)phenyl)boronic acidCas Number: 1029439-41-5Formula: C15H16BNO3 Molecular Weight: 269.11IUPAC Name: [4-[benzyl(methyl)carbamoyl]phenyl]boronic acidSMILES: B(C1=CC=C(C=C1)C(=O)N(C)CC2=CC=CC=C2)(O)OInChIKey: LPRWGAHHEXCVJU-UHFFFAOYSA-NInChI: InChI=1S/C15H16BNO3/c1-17(11-12-5-3-2-4-6-12)15(18)13-7-9-14(10-8-13)16(19)20/h2-10,19-20H,11H2,1H3
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N-Benzyl-4-bromo-3-methylbenzamideCas Number: 1020252-76-9 Compound CID: 46738729Formula: C15H14BrNO Molecular Weight: 304.18IUPAC Name: N-benzyl-4-bromo-3-methylbenzamideSMILES: CC1=C(C=CC(=C1)C(=O)NCC2=CC=CC=C2)BrInChIKey: HTUDBCRKTUDBSQ-UHFFFAOYSA-NInChI: InChI=1S/C15H14BrNO/c1-11-9-13(7-8-14(11)16)15(18)17-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,18)
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N-Benzyl-4-chlorobenzamideCas Number: 7461-34-9 Compound CID: 346668Formula: C14H12ClNO Molecular Weight: 245.7IUPAC Name: N-benzyl-4-chlorobenzamideSMILES: C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)ClInChIKey: LSMWDKIFKGLNSW-UHFFFAOYSA-NInChI: InChI=1S/C14H12ClNO/c15-13-8-6-12(7-9-13)14(17)16-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,16,17)
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N-Benzoyl-4-perhydroazepinoneCas Number: 15923-40-7 Compound CID: 12011165Formula: C13H15NO2 Molecular Weight: 217.26IUPAC Name: 1-benzoylazepan-4-oneSMILES: C1CC(=O)CCN(C1)C(=O)C2=CC=CC=C2InChIKey: CFZRTDHGRHTNHP-UHFFFAOYSA-NInChI: InChI=1S/C13H15NO2/c15-12-7-4-9-14(10-8-12)13(16)11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2
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N-Benzyl-2-hydroxybenzamideCas Number: 20919-36-2 Compound CID: 561227Formula: C14H13NO2 Molecular Weight: 227.26IUPAC Name: N-benzyl-2-hydroxybenzamideSMILES: C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2OInChIKey: FVJQVTFCHRSIMH-UHFFFAOYSA-NInChI: InChI=1S/C14H13NO2/c16-13-9-5-4-8-12(13)14(17)15-10-11-6-2-1-3-7-11/h1-9,16H,10H2,(H,15,17)
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N-(Prop-2-yn-1-yl)benzamideCas Number: 1464-98-8 Compound CID: 5020678Formula: C10H9NO Molecular Weight: 159.18IUPAC Name: N-prop-2-ynylbenzamideSMILES: C#CCNC(=O)C1=CC=CC=C1InChIKey: GWISAVFRFTWMQK-UHFFFAOYSA-NInChI: InChI=1S/C10H9NO/c1-2-8-11-10(12)9-6-4-3-5-7-9/h1,3-7H,8H2,(H,11,12)
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(3-(Thiomorpholine-4-carbonyl)phenyl)boronic acidCas Number: 850567-37-2 Compound CID: 44119535Formula: C11H14BNO3S Molecular Weight: 251.11IUPAC Name: [3-(thiomorpholine-4-carbonyl)phenyl]boronic acidSMILES: B(C1=CC(=CC=C1)C(=O)N2CCSCC2)(O)OInChIKey: KBUOGQLZRICCMV-UHFFFAOYSA-NInChI: InChI=1S/C11H14BNO3S/c14-11(13-4-6-17-7-5-13)9-2-1-3-10(8-9)12(15)16/h1-3,8,15-16H,4-7H2
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(3-(Thiazol-2-ylcarbamoyl)phenyl)boronic acidCas Number: 850567-34-9 Compound CID: 44119533Formula: C10H9BN2O3S Molecular Weight: 248.07IUPAC Name: [3-(1,3-thiazol-2-ylcarbamoyl)phenyl]boronic acidSMILES: B(C1=CC(=CC=C1)C(=O)NC2=NC=CS2)(O)OInChIKey: ORXREXRVDUFDBS-UHFFFAOYSA-NInChI: InChI=1S/C10H9BN2O3S/c14-9(13-10-12-4-5-17-10)7-2-1-3-8(6-7)11(15)16/h1-6,15-16H,(H,12,13,14)
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(3-((trans-4-Hydroxycyclohexyl)carbamoyl)phenyl)boronic acidCas Number: 957062-71-4 Compound CID: 46738655Formula: C13H18BNO4 Molecular Weight: 263.1IUPAC Name: [3-[(4-hydroxycyclohexyl)carbamoyl]phenyl]boronic acidSMILES: B(C1=CC(=CC=C1)C(=O)NC2CCC(CC2)O)(O)OInChIKey: WBAACPSTIIWUDJ-UHFFFAOYSA-NInChI: InChI=1S/C13H18BNO4/c16-12-6-4-11(5-7-12)15-13(17)9-2-1-3-10(8-9)14(18)19/h1-3,8,11-12,16,18-19H,4-7H2,(H,15,17)
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(3-((1H-1,2,4-Triazol-3-yl)carbamoyl)phenyl)boronic acid(contains varying amounts of Anhydride)Cas Number: 871333-05-0 Compound CID: 44119637Formula: C9H9BN4O3 Molecular Weight: 232.01IUPAC Name: [3-(1H-1,2,4-triazol-5-ylcarbamoyl)phenyl]boronic acidSMILES: B(C1=CC(=CC=C1)C(=O)NC2=NC=NN2)(O)OInChIKey: JXMAEIBAKRAGBL-UHFFFAOYSA-NInChI: InChI=1S/C9H9BN4O3/c15-8(13-9-11-5-12-14-9)6-2-1-3-7(4-6)10(16)17/h1-5,16-17H,(H2,11,12,13,14,15)Synonyms: 3-(1H-1,2,4-Triazol-3-ylcarbamoyl)benzeneboronic acid | N-(1H,1,2,4-Triazol-3-yl) 3-boronobenzaMide | [3-(1H-1,2,4-tr...
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(3-((1H-tetrazol-5-yl)carbamoyl)phenyl)boronic acid hydrochlorideCas Number: 850567-38-3 Compound CID: 44119544Formula: C8H9BClN5O3 Molecular Weight: 269.46IUPAC Name: [3-(2H-tetrazol-5-ylcarbamoyl)phenyl]boronic acid;hydrochlorideSMILES: B(C1=CC(=CC=C1)C(=O)NC2=NNN=N2)(O)O.ClInChIKey: PWSGJXZLSYWEAJ-UHFFFAOYSA-NInChI: InChI=1S/C8H8BN5O3.ClH/c15-7(10-8-11-13-14-12-8)5-2-1-3-6(4-5)9(16)17;/h1-4,16-17H,(H2,10,11,12,13,14,15);1H
