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

Systemtic Name: methyl 3-[(2-chlorophenyl)methyl]-2-[2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-[(2-chlorophenyl)methyl]-2-[2-(1-methylpyrrol-2-yl)-2-oxo-ethyl]sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-[(2-chlorophenyl)methyl]-2-[[2-(1-methyl-2-pyrrolyl)-2-oxoethyl]thio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chlorophenyl)methyl]-2-[2-(1-methylpyrrol-2-yl)-2-oxoethyl]sulfanyl-4-oxoquinazoline-7-carboxylate Traditional Name: 3-(2-chlorobenzyl)-4-keto-2-[[2-keto-2-(1-methylpyrrol-2-yl)ethyl]thio]quinazoline-7-carboxylic acid methyl ester Formula: C24H20ClN3O4S MolecularWeight: 481.9513

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC4=CC=CC=C4Cl

Isomeric SMILES

CN1C=CC=C1C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC4=CC=CC=C4Cl

InChI

InChI=1S/C24H20ClN3O4S/c1-27-11-5-8-20(27)21(29)14-33-24-26-19-12-15(23(31)32-2)9-10-17(19)22(30)28(24)13-16-6-3-4-7-18(16)25/h3-12H,13-14H2,1-2H3