2-[(2R)-1-[(4-methoxycarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylquinazolin-4-olate

Systemtic Name: 2-[(2R)-1-[(4-methoxycarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylquinazolin-4-olate Openeye Name: 2-[(1R)-2-(4-methoxycarbonylanilino)-1-methyl-2-oxo-ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[(2R)-1-(4-methoxycarbonylanilino)-1-oxopropan-2-yl]thio]-4-quinazolinolate IUPAC Name: 2-[(2R)-1-(4-methoxycarbonylanilino)-1-oxopropan-2-yl]sulfanylquinazolin-4-olate Traditional Name: 2-[[(1R)-2-(4-carbomethoxyanilino)-2-keto-1-methyl-ethyl]thio]quinazolin-4-olate Formula: C19H16N3O4S- MolecularWeight: 382.41304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)SC2=NC3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C(=O)OC)SC2=NC3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C19H17N3O4S/c1-11(16(23)20-13-9-7-12(8-10-13)18(25)26-2)27-19-21-15-6-4-3-5-14(15)17(24)22-19/h3-11H,1-2H3,(H,20,23)(H,21,22,24)/p-1/t11-/m1/s1