3-(3-chloranyl-2-methyl-phenyl)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-2-methyl-phenyl)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3-chloro-2-methyl-phenyl)-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-chloro-2-methylphenyl)-2-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(3-chloro-2-methylphenyl)-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylquinazolin-4-one Traditional Name: 3-(3-chloro-2-methyl-phenyl)-2-[[2-keto-2-(4-phenylphenyl)ethyl]thio]quinazolin-4-one Formula: C29H21ClN2O2S MolecularWeight: 497.00724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H21ClN2O2S/c1-19-24(30)11-7-13-26(19)32-28(34)23-10-5-6-12-25(23)31-29(32)35-18-27(33)22-16-14-21(15-17-22)20-8-3-2-4-9-20/h2-17H,18H2,1H3