ethyl 4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(4-oxo-1H-quinazolin-2-yl)thio]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(4-keto-1H-quinazolin-2-yl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C19H17N3O4S/c1-2-26-18(25)12-7-9-13(10-8-12)20-16(23)11-27-19-21-15-6-4-3-5-14(15)17(24)22-19/h3-10H,2,11H2,1H3,(H,20,23)(H,21,22,24)