Vitas-M small molecule compound
methyl 5-(dimethylcarbamoyl)-4-methyl-2-{[(4-methylcyclohexyl)carbamothioyl]amino}thiophene-3-carboxylate
Catalog ID
STK472310
SMILES COC(=O)c1c(NC(=S)NC2CCC(CC2)C)sc(c1C)C(=O)N(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 C18H27N3O3S2 MW 397.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3O3S2/c1-10-6-8-12(9-7-10)19-18(25)20-15-13(17(23)24-5)11(2)14(26-15)16(22)21(3)4/h10,12H,6-9H2,1-5H3,(H2,19,20,25)InChIKey
LEDHYYZPQIMTLQ-UHFFFAOYSA-NSynonyms
CC1CCC(CC1)NC(=S)NC2=C(C(=C(S2)C(=O)N(C)C)C)C(=O)OC
InChI=1SC18H27N3O3S2c1106812(9710)1918(25)201513(17(23)245)11(2)14(2615)16(22)21(3)4h1012H69H215H3(H2192025)
methyl5(dimethylcarbamoyl)4methyl2(((4methylcyclohexyl)carbamothioyl)amino)thiophene3carboxylate
methyl5(dimethylcarbamoyl)4methyl2((4methylcyclohexyl)carbamothioylamino)thiophene3carboxylate
METHYL5(NNDIMETHYLCARBAMOYL)4METHYL2((((4METHYLCYCLOHEXYL)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD06170879
ZINC000017081361
ZINC17081361
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