2-(2-oxidanylidenecyclohexyl)sulfanyl-3-(4-phenoxyphenyl)quinazolin-4-one

Systemtic Name: 2-(2-oxidanylidenecyclohexyl)sulfanyl-3-(4-phenoxyphenyl)quinazolin-4-one Openeye Name: 2-(2-oxocyclohexyl)sulfanyl-3-(4-phenoxyphenyl)quinazolin-4-one CAS Name: 2-[(2-oxocyclohexyl)thio]-3-(4-phenoxyphenyl)-4-quinazolinone IUPAC Name: 2-(2-oxocyclohexyl)sulfanyl-3-(4-phenoxyphenyl)quinazolin-4-one Traditional Name: 2-[(2-ketocyclohexyl)thio]-3-(4-phenoxyphenyl)quinazolin-4-one Formula: C26H22N2O3S MolecularWeight: 442.52948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CCC(=O)C(C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C26H22N2O3S/c29-23-12-6-7-13-24(23)32-26-27-22-11-5-4-10-21(22)25(30)28(26)18-14-16-20(17-15-18)31-19-8-2-1-3-9-19/h1-5,8-11,14-17,24H,6-7,12-13H2