3-(2-chlorophenyl)-2-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-chlorophenyl)-2-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2-chlorophenyl)-2-[2-(4-cyclohexylphenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-chlorophenyl)-2-[[2-(4-cyclohexylphenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(2-chlorophenyl)-2-[2-(4-cyclohexylphenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-(2-chlorophenyl)-2-[[2-(4-cyclohexylphenyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C28H25ClN2O2S MolecularWeight: 489.0283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5Cl

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5Cl

InChI

InChI=1S/C28H25ClN2O2S/c29-23-11-5-7-13-25(23)31-27(33)22-10-4-6-12-24(22)30-28(31)34-18-26(32)21-16-14-20(15-17-21)19-8-2-1-3-9-19/h4-7,10-17,19H,1-3,8-9,18H2