Vitas-M small molecule compound
4-methoxy-N-[1-(4-methyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK289053
SMILES COc1ccc(cc1)C(=O)NC(c1nnc(n1C)SCC(=O)N1CCN(CC1)c1ccccc1)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 C25H30N6O3S MW 494.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N6O3S/c1-18(26-24(33)19-9-11-21(34-3)12-10-19)23-27-28-25(29(23)2)35-17-22(32)31-15-13-30(14-16-31)20-7-5-4-6-8-20/h4-12,18H,13-17H2,1-3H3,(H,26,33)InChIKey
MCQMBKLHKNWYFU-UHFFFAOYSA-NSynonyms
4METHOXYN(1(4METHYL5((2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4METHOXYN(1(4METHYL5(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CC(C1=NN=C(N1C)SCC(=O)N2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)OC
InChI=1SC25H30N6O3Sc118(2624(33)1991121(343)121019)23272825(29(23)2)351722(32)31151330(141631)207546820h41218H1317H213H3(H2633)
MFCD06007194
ZINC000012383982
ZINC000012383983
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