Vitas-M small molecule compound
methyl 2-({[4-(3-methoxybenzyl)piperazin-1-yl]carbonothioyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK457949
SMILES COc1cccc(c1)CN1CCN(CC1)C(=S)Nc1sc(c(c1C(=O)OC)C)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 C21H27N3O3S2 MW 433.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O3S2/c1-14-15(2)29-19(18(14)20(25)27-4)22-21(28)24-10-8-23(9-11-24)13-16-6-5-7-17(12-16)26-3/h5-7,12H,8-11,13H2,1-4H3,(H,22,28)InChIKey
IAXPZRJMRAONAY-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)CC3=CC(=CC=C3)OC)C
InChI=1SC21H27N3O3S2c11415(2)2919(18(14)20(25)274)2221(28)2410823(91124)131665717(1216)263h5712H81113H214H3(H2228)
METHYL2(((4((3METHOXYPHENYL)METHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
methyl2(((4(3methoxybenzyl)piperazin1yl)carbonothioyl)amino)45dimethylthiophene3carboxylate
METHYL2(((4(3METHOXYBENZYL)PIPERAZIN1YL)CARBOTHIOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
METHYL2((4((3METHOXYPHENYL)METHYL)PIPERAZINE1CARBOTHIOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD05066058
ZINC000016347030
ZINC16347030
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