methyl 3-(3-methoxypropyl)-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-(3-methoxypropyl)-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-(3-methoxypropyl)-4-oxo-2-(p-tolylmethylsulfanyl)quinazoline-7-carboxylate CAS Name: 3-(3-methoxypropyl)-2-[(4-methylphenyl)methylthio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-methoxypropyl)-2-[(4-methylphenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxylate Traditional Name: 4-keto-3-(3-methoxypropyl)-2-[(4-methylbenzyl)thio]quinazoline-7-carboxylic acid methyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCCOC

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCCOC

InChI

InChI=1S/C22H24N2O4S/c1-15-5-7-16(8-6-15)14-29-22-23-19-13-17(21(26)28-3)9-10-18(19)20(25)24(22)11-4-12-27-2/h5-10,13H,4,11-12,14H2,1-3H3