2-[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-[(4-methylphenyl)methyl]quinazolin-4-one

Systemtic Name: 2-[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-[(4-methylphenyl)methyl]quinazolin-4-one Openeye Name: 2-[2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(p-tolylmethyl)quinazolin-4-one CAS Name: 2-[[1-(4-ethylphenyl)-1-oxopropan-2-yl]thio]-3-[(4-methylphenyl)methyl]-4-quinazolinone IUPAC Name: 2-[1-(4-ethylphenyl)-1-oxopropan-2-yl]sulfanyl-3-[(4-methylphenyl)methyl]quinazolin-4-one Traditional Name: 2-[[2-(4-ethylphenyl)-2-keto-1-methyl-ethyl]thio]-3-(4-methylbenzyl)quinazolin-4-one Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)C

InChI

InChI=1S/C27H26N2O2S/c1-4-20-13-15-22(16-14-20)25(30)19(3)32-27-28-24-8-6-5-7-23(24)26(31)29(27)17-21-11-9-18(2)10-12-21/h5-16,19H,4,17H2,1-3H3