Vitas-M small molecule compound

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

Catalog ID
STK024069
SMILES COc1cc(ccc1OC)C1N(N=C(N1c1ccc(c(c1)Cl)N1CCCCC1)C(=O)C)c1ccc(cc1)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 C30H33ClN4O3 MW 533.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33ClN4O3/c1-20-8-11-23(12-9-20)35-30(22-10-15-27(37-3)28(18-22)38-4)34(29(32-35)21(2)36)24-13-14-26(25(31)19-24)33-16-6-5-7-17-33/h8-15,18-19,30H,5-7,16-17H2,1-4H3
InChIKey
GKJADMKNWIFAAO-UHFFFAOYSA-N
Synonyms

1(4(3CHLORO4(1PIPERIDINYL)PHENYL)5(34DIMETHOXYPHENYL)1(4METHYLPHENYL)45DIHYDRO1H124TRIAZOL3YL)ETHANONE
1(4(3CHLORO4(PIPERIDIN1YL)PHENYL)5(34DIMETHOXYPHENYL)1(4METHYLPHENYL)45DIHYDRO1H124TRIAZOL3YL)ETHANONE
1(4(3CHLORO4PIPERIDIN1YLPHENYL)3(34DIMETHOXYPHENYL)2(4METHYLPHENYL)3H124TRIAZOL5YL)ETHANONE
CC1=CC=C(C=C1)N2C(N(C(=N2)C(=O)C)C3=CC(=C(C=C3)N4CCCCC4)Cl)C5=CC(=C(C=C5)OC)OC
COc1cc(ccc1OC)C1N(N=C(N1c1ccc(c(c1)Cl)N1CCCCC1)C(=O)C)c1ccc(cc1)C
InChI=1SC30H33ClN4O3c12081123(12920)3530(22101527(373)28(1822)384)34(29(3235)21(2)36)24131426(25(31)1924)33166571733h815181930H571617H214H3
MFCD02182370
STK024069
ZINC000002138101
ZINC000002138103

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Available files

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