methyl 4,5-dimethyl-2-(naphthalen-1-ylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-(naphthalen-1-ylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-(1-naphthylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-(naphthalen-1-ylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-(1-naphthylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C19H18N2O2S2 MolecularWeight: 370.48842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC3=CC=CC=C32)C

InChI

InChI=1S/C19H18N2O2S2/c1-11-12(2)25-17(16(11)18(22)23-3)21-19(24)20-15-10-6-8-13-7-4-5-9-14(13)15/h4-10H,1-3H3,(H2,20,21,24)