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

Systemtic Name: 2-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2,4-dimethylphenyl)quinazolin-4-one Openeye Name: 2-[2-(4-cyclohexylphenyl)-2-oxo-ethyl]sulfanyl-3-(2,4-dimethylphenyl)quinazolin-4-one CAS Name: 2-[[2-(4-cyclohexylphenyl)-2-oxoethyl]thio]-3-(2,4-dimethylphenyl)-4-quinazolinone IUPAC Name: 2-[2-(4-cyclohexylphenyl)-2-oxoethyl]sulfanyl-3-(2,4-dimethylphenyl)quinazolin-4-one Traditional Name: 2-[[2-(4-cyclohexylphenyl)-2-keto-ethyl]thio]-3-(2,4-dimethylphenyl)quinazolin-4-one Formula: C30H30N2O2S MolecularWeight: 482.6364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)C5CCCCC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)C5CCCCC5)C

InChI

InChI=1S/C30H30N2O2S/c1-20-12-17-27(21(2)18-20)32-29(34)25-10-6-7-11-26(25)31-30(32)35-19-28(33)24-15-13-23(14-16-24)22-8-4-3-5-9-22/h6-7,10-18,22H,3-5,8-9,19H2,1-2H3