Vitas-M small molecule compound
ethyl 4-{[3-(3,4-dimethoxyphenyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}piperazine-1-carboxylate
Catalog ID
STK733137
SMILES CCOC(=O)N1CCN(CC1)Cn1nc(n(c1=S)c1ccccc1)c1ccc(c(c1)OC)OC
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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 C24H29N5O4S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O4S/c1-4-33-24(30)27-14-12-26(13-15-27)17-28-23(34)29(19-8-6-5-7-9-19)22(25-28)18-10-11-20(31-2)21(16-18)32-3/h5-11,16H,4,12-15,17H2,1-3H3InChIKey
NKMUDWZJCJNOEL-UHFFFAOYSA-NSynonyms
311797-01-0311797010
CCOC(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4
ETHYL4((3(34DIMETHOXYPHENYL)4PHENYL5SULFANYLIDENE124TRIAZOL1YL)METHYL)PIPERAZINE1CARBOXYLATE
ETHYL4((3(34DIMETHOXYPHENYL)4PHENYL5THIOXO45DIHYDRO1H124TRIAZOL1YL)METHYL)1PIPERAZINECARBOXYLATE
ETHYL4((3(34DIMETHOXYPHENYL)4PHENYL5THIOXO45DIHYDRO1H124TRIAZOL1YL)METHYL)PIPERAZINE1CARBOXYLATE
InChI=1SC24H29N5O4Sc143324(30)27141226(131527)172823(34)29(198657919)22(2528)18101120(312)21(1618)323h51116H4121517H213H3
MFCD01204569
ZINC000019597111
ZINC19597111
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