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

Systemtic Name: methyl 4-ethyl-5-methyl-2-(naphthalen-1-ylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-(1-naphthylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-5-methyl-2-(naphthalen-1-ylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-(1-naphthylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C20H20N2O2S2 MolecularWeight: 384.515

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC3=CC=CC=C32)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC3=CC=CC=C32)C

InChI

InChI=1S/C20H20N2O2S2/c1-4-14-12(2)26-18(17(14)19(23)24-3)22-20(25)21-16-11-7-9-13-8-5-6-10-15(13)16/h5-11H,4H2,1-3H3,(H2,21,22,25)