2-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl]sulfanyl-3-phenyl-quinazolin-4-one

Systemtic Name: 2-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl]sulfanyl-3-phenyl-quinazolin-4-one Openeye Name: 2-[2-(4-benzoylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-3-phenyl-quinazolin-4-one CAS Name: 2-[[2-(4-benzoyl-1-piperazinyl)-2-oxoethyl]thio]-3-phenyl-4-quinazolinone IUPAC Name: 2-[2-(4-benzoylpiperazin-1-yl)-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one Traditional Name: 2-[[2-(4-benzoylpiperazino)-2-keto-ethyl]thio]-3-phenyl-quinazolin-4-one Formula: C27H24N4O3S MolecularWeight: 484.56946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4O3S/c32-24(29-15-17-30(18-16-29)25(33)20-9-3-1-4-10-20)19-35-27-28-23-14-8-7-13-22(23)26(34)31(27)21-11-5-2-6-12-21/h1-14H,15-19H2