Vitas-M small molecule compound
dipropan-2-yl 5-({[5-(diethylcarbamoyl)-3-(methoxycarbonyl)-4-methylthiophen-2-yl]carbamothioyl}amino)benzene-1,3-dicarboxylate
Catalog ID
STK456207
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)Nc1cc(cc(c1)C(=O)OC(C)C)C(=O)OC(C)C)CC
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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 C27H35N3O7S2 MW 577.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N3O7S2/c1-9-30(10-2)23(31)21-16(7)20(26(34)35-8)22(39-21)29-27(38)28-19-12-17(24(32)36-14(3)4)11-18(13-19)25(33)37-15(5)6/h11-15H,9-10H2,1-8H3,(H2,28,29,38)InChIKey
CCSJIHYSSMSNRV-UHFFFAOYSA-NSynonyms
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=CC(=CC(=C2)C(=O)OC(C)C)C(=O)OC(C)C)C(=O)OC)C
dipropan2yl5(((5(diethylcarbamoyl)3(methoxycarbonyl)4methylthiophen2yl)carbamothioyl)amino)benzene13dicarboxylate
DIPROPAN2YL5((5(DIETHYLCARBAMOYL)3METHOXYCARBONYL4METHYLTHIOPHEN2YL)CARBAMOTHIOYLAMINO)BENZENE13DICARBOXYLATE
InChI=1SC27H35N3O7S2c1930(102)23(31)2116(7)20(26(34)358)22(3921)2927(38)28191217(24(32)3614(3)4)1118(1319)25(33)3715(5)6h1115H910H218H3(H2282938)
METHYL5(NNDIETHYLCARBAMOYL)2((((35BIS((METHYLETHYL)OXYCARBONYL)PHENYL)AMINO)THIOXOMETHYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD05991641
ZINC000059775882
ZINC59775882
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