methyl 3-[(4-ethoxyphenyl)carbamothioylcarbamoyl]benzoate

Systemtic Name: methyl 3-[(4-ethoxyphenyl)carbamothioylcarbamoyl]benzoate Openeye Name: methyl 3-[(4-ethoxyphenyl)carbamothioylcarbamoyl]benzoate CAS Name: 3-[[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-ethoxyphenyl)carbamothioylcarbamoyl]benzoate Traditional Name: 3-(p-phenetylthiocarbamoylcarbamoyl)benzoic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C18H18N2O4S/c1-3-24-15-9-7-14(8-10-15)19-18(25)20-16(21)12-5-4-6-13(11-12)17(22)23-2/h4-11H,3H2,1-2H3,(H2,19,20,21,25)