methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(4-methylpiperazin-1-yl)carbothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(4-methylpiperazin-1-yl)carbothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(4-methylpiperazine-1-carbothioyl)amino]thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[(4-methyl-1-piperazinyl)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(4-methylpiperazine-1-carbothioyl)amino]thiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-4-methyl-2-[(4-methylpiperazine-1-carbothioyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C16H24N4O3S2 MolecularWeight: 384.51676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)C)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)C)C(=O)N(C)C

InChI

InChI=1S/C16H24N4O3S2/c1-10-11(15(22)23-5)13(25-12(10)14(21)18(2)3)17-16(24)20-8-6-19(4)7-9-20/h6-9H2,1-5H3,(H,17,24)