methyl 4-[(2-ethoxyphenyl)carbamothioylcarbamoyl]benzoate

Systemtic Name: methyl 4-[(2-ethoxyphenyl)carbamothioylcarbamoyl]benzoate Openeye Name: methyl 4-[(2-ethoxyphenyl)carbamothioylcarbamoyl]benzoate CAS Name: 4-[[[(2-ethoxyanilino)-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-ethoxyphenyl)carbamothioylcarbamoyl]benzoate Traditional Name: 4-(o-phenetylthiocarbamoylcarbamoyl)benzoic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

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