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

Systemtic Name: 2-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[2-(4-cyclohexylphenyl)-2-oxo-ethyl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one CAS Name: 2-[[2-(4-cyclohexylphenyl)-2-oxoethyl]thio]-3-(2-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[2-(4-cyclohexylphenyl)-2-oxoethyl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[[2-(4-cyclohexylphenyl)-2-keto-ethyl]thio]-3-(2-methoxyphenyl)quinazolin-4-one Formula: C29H28N2O3S MolecularWeight: 484.60922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)C5CCCCC5

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)C5CCCCC5

InChI

InChI=1S/C29H28N2O3S/c1-34-27-14-8-7-13-25(27)31-28(33)23-11-5-6-12-24(23)30-29(31)35-19-26(32)22-17-15-21(16-18-22)20-9-3-2-4-10-20/h5-8,11-18,20H,2-4,9-10,19H2,1H3