ethyl 4-[(3-acetamidophenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(3-acetamidophenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(3-acetamidophenyl)carbamothioylamino]benzoate CAS Name: 4-[[(3-acetamidoanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-acetamidophenyl)carbamothioylamino]benzoate Traditional Name: 4-[(3-acetamidophenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)NC(=O)C

InChI

InChI=1S/C18H19N3O3S/c1-3-24-17(23)13-7-9-14(10-8-13)20-18(25)21-16-6-4-5-15(11-16)19-12(2)22/h4-11H,3H2,1-2H3,(H,19,22)(H2,20,21,25)