7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-2-(3-oxidanylidenebutylsulfanyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-2-(3-oxidanylidenebutylsulfanyl)quinazolin-4-one Openeye Name: 7-chloro-3-(2-methoxy-5-methyl-phenyl)-2-(3-oxobutylsulfanyl)quinazolin-4-one CAS Name: 7-chloro-3-(2-methoxy-5-methylphenyl)-2-(3-oxobutylthio)-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methoxy-5-methylphenyl)-2-(3-oxobutylsulfanyl)quinazolin-4-one Traditional Name: 7-chloro-2-(3-ketobutylthio)-3-(2-methoxy-5-methyl-phenyl)quinazolin-4-one Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCC(=O)C

InChI

InChI=1S/C20H19ClN2O3S/c1-12-4-7-18(26-3)17(10-12)23-19(25)15-6-5-14(21)11-16(15)22-20(23)27-9-8-13(2)24/h4-7,10-11H,8-9H2,1-3H3