methyl 4,5-dimethyl-2-[(4-methylphenyl)methylcarbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[(4-methylphenyl)methylcarbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-(p-tolylmethylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[[(4-methylphenyl)methylamino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[(4-methylphenyl)methylcarbamothioylamino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[(4-methylbenzyl)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C17H20N2O2S2 MolecularWeight: 348.4829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC

InChI

InChI=1S/C17H20N2O2S2/c1-10-5-7-13(8-6-10)9-18-17(22)19-15-14(16(20)21-4)11(2)12(3)23-15/h5-8H,9H2,1-4H3,(H2,18,19,22)