Vitas-M small molecule compound

methyl 5-(dimethylcarbamoyl)-4-methyl-2-{[(1-methylpiperidin-4-yl)carbamothioyl]amino}thiophene-3-carboxylate

Catalog ID
STK495191
SMILES COC(=O)c1c(NC(=S)NC2CCN(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 C17H26N4O3S2 MW 398.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H26N4O3S2/c1-10-12(16(23)24-5)14(26-13(10)15(22)20(2)3)19-17(25)18-11-6-8-21(4)9-7-11/h11H,6-9H2,1-5H3,(H2,18,19,25)
InChIKey
HDVNDUBIAAQXRG-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2CCN(CC2)C)C(=O)N(C)C
InChI=1SC17H26N4O3S2c11012(16(23)245)14(2613(10)15(22)20(2)3)1917(25)18116821(4)9711h11H69H215H3(H2181925)
methyl5(dimethylcarbamoyl)4methyl2(((1methylpiperidin4yl)carbamothioyl)amino)thiophene3carboxylate
methyl5(dimethylcarbamoyl)4methyl2((1methylpiperidin4yl)carbamothioylamino)thiophene3carboxylate
MFCD07074450
ZINC000013775648
ZINC13775648

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.