2-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-chloranyl-2-methoxy-5-methyl-phenyl)quinazolin-4-one

Systemtic Name: 2-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-chloranyl-2-methoxy-5-methyl-phenyl)quinazolin-4-one Openeye Name: 2-[2-(4-tert-butylphenyl)-2-oxo-ethyl]sulfanyl-3-(4-chloro-2-methoxy-5-methyl-phenyl)quinazolin-4-one CAS Name: 2-[[2-(4-tert-butylphenyl)-2-oxoethyl]thio]-3-(4-chloro-2-methoxy-5-methylphenyl)-4-quinazolinone IUPAC Name: 2-[2-(4-tert-butylphenyl)-2-oxoethyl]sulfanyl-3-(4-chloro-2-methoxy-5-methylphenyl)quinazolin-4-one Traditional Name: 2-[[2-(4-tert-butylphenyl)-2-keto-ethyl]thio]-3-(4-chloro-2-methoxy-5-methyl-phenyl)quinazolin-4-one Formula: C28H27ClN2O3S MolecularWeight: 507.04358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C28H27ClN2O3S/c1-17-14-23(25(34-5)15-21(17)29)31-26(33)20-8-6-7-9-22(20)30-27(31)35-16-24(32)18-10-12-19(13-11-18)28(2,3)4/h6-15H,16H2,1-5H3