2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-propan-2-ylphenyl)quinazolin-4-one

Systemtic Name: 2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-propan-2-ylphenyl)quinazolin-4-one Openeye Name: 2-[2-(4-ethylphenyl)-2-oxo-ethyl]sulfanyl-3-(2-isopropylphenyl)quinazolin-4-one CAS Name: 2-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-3-(2-propan-2-ylphenyl)-4-quinazolinone IUPAC Name: 2-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-3-(2-propan-2-ylphenyl)quinazolin-4-one Traditional Name: 2-[[2-(4-ethylphenyl)-2-keto-ethyl]thio]-3-o-cumenyl-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)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(C)C

InChI

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