Vitas-M small molecule compound
2-{[4-(3-chloro-4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethanone
Catalog ID
STK233095
SMILES O=C(N1CCN(CC1)c1ccccc1)CSc1nnc(n1c1ccc(c(c1)Cl)C)c1ccccc1
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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 C27H26ClN5OS MW 504.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN5OS/c1-20-12-13-23(18-24(20)28)33-26(21-8-4-2-5-9-21)29-30-27(33)35-19-25(34)32-16-14-31(15-17-32)22-10-6-3-7-11-22/h2-13,18H,14-17,19H2,1H3InChIKey
DAMVILRJJFPCPZ-UHFFFAOYSA-NSynonyms
2((4(3CHLORO4METHYLPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
2((4(3chloro4methylphenyl)5phenyl4H124triazol3yl)sulfanyl)1(4phenylpiperazin1yl)ethanone
CC1=C(C=C(C=C1)N2C(=NN=C2SCC(=O)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5)Cl
InChI=1SC27H26ClN5OSc120121323(1824(20)28)3326(218425921)293027(33)351925(34)32161431(151732)22106371122h21318H141719H21H3
MFCD06629141
ZINC000009291030
ZINC09291030
ZINC9291030
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