methyl 2-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-chloro-2-methyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chloro-2-methylphenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(3-chloro-2-methyl-phenyl)thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C16H17ClN2O2S2 MolecularWeight: 368.90138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(C(=CC=C2)Cl)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(C(=CC=C2)Cl)C)C

InChI

InChI=1S/C16H17ClN2O2S2/c1-8-10(3)23-14(13(8)15(20)21-4)19-16(22)18-12-7-5-6-11(17)9(12)2/h5-7H,1-4H3,(H2,18,19,22)