7-chloranyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-propan-2-yloxypropyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-propan-2-yloxypropyl)quinazolin-4-one Openeye Name: 7-chloro-3-(3-isopropoxypropyl)-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-3-(3-propan-2-yloxypropyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-3-(3-propan-2-yloxypropyl)quinazolin-4-one Traditional Name: 7-chloro-3-(3-isopropoxypropyl)-2-[[2-keto-2-(p-tolyl)ethyl]thio]quinazolin-4-one Formula: C23H25ClN2O3S MolecularWeight: 444.9742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25ClN2O3S/c1-15(2)29-12-4-11-26-22(28)19-10-9-18(24)13-20(19)25-23(26)30-14-21(27)17-7-5-16(3)6-8-17/h5-10,13,15H,4,11-12,14H2,1-3H3