Vitas-M small molecule compound

1-{4-[3-chloro-4-(piperidin-1-yl)phenyl]-5-(1H-indol-3-yl)-1-(4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone

Catalog ID
STK744170
SMILES Cc1ccc(cc1)N1N=C(N(C1c1c[nH]c2c1cccc2)c1ccc(c(c1)Cl)N1CCCCC1)C(=O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H30ClN5O MW 512.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30ClN5O/c1-20-10-12-22(13-11-20)36-30(25-19-32-27-9-5-4-8-24(25)27)35(29(33-36)21(2)37)23-14-15-28(26(31)18-23)34-16-6-3-7-17-34/h4-5,8-15,18-19,30,32H,3,6-7,16-17H2,1-2H3
InChIKey
GZRIHGSWVGZAGI-UHFFFAOYSA-N
Synonyms

1(4(3chloro4(piperidin1yl)phenyl)5(1Hindol3yl)1(4methylphenyl)45dihydro1H124triazol3yl)ethanone
1(4(3chloro4(piperidin1yl)phenyl)5(1Hindol3yl)1(ptolyl)45dihydro1H124triazol3yl)ethanone
1(4(3CHLORO4PIPERIDIN1YLPHENYL)3(1HINDOL3YL)2(4METHYLPHENYL)3H124TRIAZOL5YL)ETHANONE
CC1=CC=C(C=C1)N2C(N(C(=N2)C(=O)C)C3=CC(=C(C=C3)N4CCCCC4)Cl)C5=CNC6=CC=CC=C65
Cc1ccc(cc1)N1N=C(N(C1c1c(nH)c2c1cccc2)c1ccc(c(c1)Cl)N1CCCCC1)C(=O)C
InChI=1SC30H30ClN5Oc120101222(131120)3630(25193227954824(25)27)35(29(3336)21(2)37)23141528(26(31)1823)34166371734h4581518193032H3671617H212H3
MFCD02182372
ZINC000002138110
ZINC000002138116

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Available files

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