Vitas-M small molecule compound
1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-{[5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK261197
SMILES C=CCn1c(SCC(=O)N2CCN(CC2)c2ccccc2OC)nnc1c1cccc(c1)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 C25H29N5O2S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O2S/c1-4-12-30-24(20-9-7-8-19(2)17-20)26-27-25(30)33-18-23(31)29-15-13-28(14-16-29)21-10-5-6-11-22(21)32-3/h4-11,17H,1,12-16,18H2,2-3H3InChIKey
QIAOIBYVZWCEBU-UHFFFAOYSA-NSynonyms
1(4(2METHOXYPHENYL)PIPERAZIN1YL)2((5(3METHYLPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(4(2methoxyphenyl)piperazin1yl)2((5(3methylphenyl)4prop2enyl124triazol3yl)sulfanyl)ethanone
2(4ALLYL5MTOLYL4H(124)TRIAZOL3YLSULFANYL)1(4(2METHOXYPHENYL)PIPERAZIN1YL)ETHANONE
CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC(=O)N3CCN(CC3)C4=CC=CC=C4OC
InChI=1SC25H29N5O2Sc14123024(2097819(2)1720)262725(30)331823(31)29151328(141629)2110561122(21)323h41117H1121618H223H3
MFCD08670989
ZINC000009504552
ZINC09504552
ZINC9504552
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