methyl 4-ethyl-5-methyl-2-[[phenyl-(phenylmethyl)carbamothioyl]amino]thiophene-3-carboxylate

Systemtic Name: methyl 4-ethyl-5-methyl-2-[[phenyl-(phenylmethyl)carbamothioyl]amino]thiophene-3-carboxylate Openeye Name: methyl 2-[[benzyl(phenyl)carbamothioyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[(N-(phenylmethyl)anilino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[benzyl(phenyl)carbamothioyl]amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[[benzyl(phenyl)thiocarbamoyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C23H24N2O2S2 MolecularWeight: 424.57886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)N(CC2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)N(CC2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C23H24N2O2S2/c1-4-19-16(2)29-21(20(19)22(26)27-3)24-23(28)25(18-13-9-6-10-14-18)15-17-11-7-5-8-12-17/h5-14H,4,15H2,1-3H3,(H,24,28)