1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylbenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC=CC=C3SCC(=O)N

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC=CC=C3SCC(=O)N

InChI

InChI=1S/C19H17N3O4S/c1-11(17-21-14-8-4-2-6-12(14)18(24)22-17)26-19(25)13-7-3-5-9-15(13)27-10-16(20)23/h2-9,11H,10H2,1H3,(H2,20,23)(H,21,22,24)