Vitas-M small molecule compound
methyl 4-ethyl-5-methyl-2-({[4-(pyrimidin-2-yl)piperazin-1-yl]carbonothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK456177
SMILES COC(=O)c1c(NC(=S)N2CCN(CC2)c2ncccn2)sc(c1CC)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 C18H23N5O2S2 MW 405.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O2S2/c1-4-13-12(2)27-15(14(13)16(24)25-3)21-18(26)23-10-8-22(9-11-23)17-19-6-5-7-20-17/h5-7H,4,8-11H2,1-3H3,(H,21,26)InChIKey
TXKHVNVPLSXBNL-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)C3=NC=CC=N3)C
InChI=1SC18H23N5O2S2c141312(2)2715(14(13)16(24)253)2118(26)2310822(91123)17196572017h57H4811H213H3(H2126)
methyl4ethyl5methyl2(((4(pyrimidin2yl)piperazin1yl)carbonothioyl)amino)thiophene3carboxylate
METHYL4ETHYL5METHYL2(((4PYRIMIDIN2YLPIPERAZINYL)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL4ETHYL5METHYL2((4PYRIMIDIN2YLPIPERAZINE1CARBOTHIOYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD05991122
ZINC000001121750
ZINC01121750
ZINC1121750
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