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N-substituted imidazoles
Description:
Heterocyclic compounds containing an imidazole ring substituted at position 1.
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1，4-Dimethyl-1H-ImidazoleIUPAC Name: 1,4-dimethylimidazoleSMILES: CC1=CN(C=N1)CInChIKey: BLHTXORQJNCSII-UHFFFAOYSA-NInChI: InChI=1S/C5H8N2/c1-5-3-7(2)4-6-5/h3-4H,1-2H3 -
1，4，5-Trimethyl-1H-imidazoleCas Number: 20185-22-2 Compound CID: 573598Formula: C6H10N2 Molecular Weight: 110.16IUPAC Name: 1,4,5-trimethylimidazoleSMILES: CC1=C(N(C=N1)C)CInChIKey: RDTIFYBSPQERAS-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2/c1-5-6(2)8(3)4-7-5/h4H,1-3H3
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1-Methylimidazole-4-sulfonyl chlorideCas Number: 137049-00-4 Compound CID: 2736887Formula: C4H5ClN2O2S Molecular Weight: 180.61IUPAC Name: 1-methylimidazole-4-sulfonyl chlorideSMILES: CN1C=C(N=C1)S(=O)(=O)ClInChIKey: KXUGUWTUFUWYRS-UHFFFAOYSA-NInChI: InChI=1S/C4H5ClN2O2S/c1-7-2-4(6-3-7)10(5,8)9/h2-3H,1H3
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1-Butyl-2-methyl-1H-imidazoleCas Number: 13435-22-8 Compound CID: 304622Formula: C8H14N2 Molecular Weight: 138.21IUPAC Name: 1-butyl-2-methylimidazoleSMILES: CCCCN1C=CN=C1CInChIKey: WHLZPGRDRYCVRQ-UHFFFAOYSA-NInChI: InChI=1S/C8H14N2/c1-3-4-6-10-7-5-9-8(10)2/h5,7H,3-4,6H2,1-2H3
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1-(3-Chloropropyl)-1H-imidazoleCas Number: 53710-78-4 Compound CID: 15753675Formula: C6H9ClN2 Molecular Weight: 144.6IUPAC Name: 1-(3-chloropropyl)imidazoleSMILES: C1=CN(C=N1)CCCClInChIKey: ALIORLVEFABXRY-UHFFFAOYSA-NInChI: InChI=1S/C6H9ClN2/c7-2-1-4-9-5-3-8-6-9/h3,5-6H,1-2,4H2
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2-(Chloromethyl)-1-methyl-1H-imidazoleCas Number: 19225-92-4 Compound CID: 736536Formula: C5H7ClN2 Molecular Weight: 130.58IUPAC Name: 2-(chloromethyl)-1-methylimidazoleSMILES: CN1C=CN=C1CClInChIKey: VYEGAEUUQMJXTM-UHFFFAOYSA-NInChI: InChI=1S/C5H7ClN2/c1-8-3-2-7-5(8)4-6/h2-3H,4H2,1H3
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1-Hexyl-2，3-Dimethylimidazolium TrifluoromethansulfonateCas Number: 797789-01-6 Compound CID: 2734251Formula: 11H21N2·CF3O3SIUPAC Name: 1-hexyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonateSMILES: CCCCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]InChIKey: BQBJIBLQQWXKBH-UHFFFAOYSA-MInChI: InChI=1S/C11H21N2.CHF3O3S/c1-4-5-6-7-8-13-10-9-12(3)11(13)2;2-1(3,4)8(5,6)7/h9-10H,4-8H2,1-3H3;(H,5,6,7)/q+1;/p-1
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1-CyclopropylimidazoleCas Number: 135207-17-9 Compound CID: 10034603Formula: C6H8N2 Molecular Weight: 108.14IUPAC Name: 1-cyclopropylimidazoleSMILES: C1CC1N2C=CN=C2InChIKey: LMUSCNPAUSJVDG-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2/c1-2-6(1)8-4-3-7-5-8/h3-6H,1-2H2
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(6-Methylimidazo[2，1-b]thiazol-5-yl)methanolCas Number: 76919-40-9 Compound CID: 332985Formula: C7H8N2OS Molecular Weight: 168.22IUPAC Name: (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanolSMILES: CC1=C(N2C=CSC2=N1)COInChIKey: RNCFSVSYFCIZPM-UHFFFAOYSA-NInChI: InChI=1S/C7H8N2OS/c1-5-6(4-10)9-2-3-11-7(9)8-5/h2-3,10H,4H2,1H3
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1-NonylimidazoleCas Number: 53657-08-2 Compound CID: 193906Formula: C12H22N2 Molecular Weight: 194.32IUPAC Name: 1-nonylimidazoleSMILES: CCCCCCCCCN1C=CN=C1InChIKey: KCWDRMKPLNYFEA-UHFFFAOYSA-NInChI: InChI=1S/C12H22N2/c1-2-3-4-5-6-7-8-10-14-11-9-13-12-14/h9,11-12H,2-8,10H2,1H3Synonyms: 1-Nonylimidazole | 1-Nonyl-1H-imidazole | MFCD01088821 | 1H-Imidazole, 1-nonyl- | DTXSID80201891 | AC1346 | BDBM50028...
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3-(1H-Imidazol-1-yl)propanoic acid hydrochlorideCas Number: 96144-21-7 Compound CID: 44826592Formula: C6H9ClN2O2 Molecular Weight: 176.6IUPAC Name: 3-imidazol-1-ylpropanoic acid;hydrochlorideSMILES: C1=CN(C=N1)CCC(=O)O.ClInChIKey: LJTSCPQVRYTDRH-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2O2.ClH/c9-6(10)1-3-8-4-2-7-5-8;/h2,4-5H,1,3H2,(H,9,10);1H
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PadsevonilCas Number: 1294000-61-5 Compound CID: 52911611Formula: C14H14ClF5N4O2S Molecular Weight: 432.80IUPAC Name: (4R)-4-(2-chloro-2,2-difluoroethyl)-1-[[2-(methoxymethyl)-6-(trifluoromethyl)imidazo[2,1-b][1,3,4]thiadiazol-5-yl]methyl]pyrrolidin-2-oneSMILES: COCC1=NN2C(=C(N=C2S1)C(F)(F)F)CN3CC(CC3=O)CC(F)(F)ClInChIKey: DCXFIOLWWRXEQH-SSDOTTSWSA-NInChI: InChI=1S/C14H14ClF5N4O2S/c1-26-6-9-22-24-8(11(14(18,19)20)21-12(24)27-9)5-23-4-7(2-10(23)25)3-13(15,16)17/h7H,2-6H2,1H3/t7-/m1/s1Synonyms: Padsevonil [USAN] | Padsevonil | Padsevonil [INN] | UCB1415943-000 | UCB0942 | UCB-0942 | 0R1HN52K0N
