methyl 2-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfanyl-3-[(2-chlorophenyl)methyl]-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfanyl-3-[(2-chlorophenyl)methyl]-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-(2-amino-1-methyl-2-oxo-ethyl)sulfanyl-3-[(2-chlorophenyl)methyl]-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[(1-amino-1-oxopropan-2-yl)thio]-3-[(2-chlorophenyl)methyl]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(1-amino-1-oxopropan-2-yl)sulfanyl-3-[(2-chlorophenyl)methyl]-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[(2-amino-2-keto-1-methyl-ethyl)thio]-3-(2-chlorobenzyl)-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)SC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CC3=CC=CC=C3Cl

Isomeric SMILES

CC(C(=O)N)SC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H18ClN3O4S/c1-11(17(22)25)29-20-23-16-9-12(19(27)28-2)7-8-14(16)18(26)24(20)10-13-5-3-4-6-15(13)21/h3-9,11H,10H2,1-2H3,(H2,22,25)