3-(4-butan-2-ylphenyl)-2-(1-oxidanylidene-1-phenyl-propan-2-yl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-butan-2-ylphenyl)-2-(1-oxidanylidene-1-phenyl-propan-2-yl)sulfanyl-quinazolin-4-one Openeye Name: 2-(1-methyl-2-oxo-2-phenyl-ethyl)sulfanyl-3-(4-sec-butylphenyl)quinazolin-4-one CAS Name: 3-(4-butan-2-ylphenyl)-2-[(1-oxo-1-phenylpropan-2-yl)thio]-4-quinazolinone IUPAC Name: 3-(4-butan-2-ylphenyl)-2-(1-oxo-1-phenylpropan-2-yl)sulfanylquinazolin-4-one Traditional Name: 2-[(2-keto-1-methyl-2-phenyl-ethyl)thio]-3-(4-sec-butylphenyl)quinazolin-4-one Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)C4=CC=CC=C4

InChI

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