ethyl 4-[[2-[(phenylmethyl)amino]-2-sulfanylidene-ethanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[(phenylmethyl)amino]-2-sulfanylidene-ethanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-(benzylamino)-2-thioxo-acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(phenylmethyl)amino]-2-sulfanylideneethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(benzylamino)-2-sulfanylideneacetyl]amino]benzoate Traditional Name: 4-[[2-(benzylamino)-2-thioxo-acetyl]amino]benzoic acid ethyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O3S/c1-2-23-18(22)14-8-10-15(11-9-14)20-16(21)17(24)19-12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H,19,24)(H,20,21)