2-phenacylsulfanyl-3-phenyl-7-(4-phenylpiperazin-1-yl)carbonyl-quinazolin-4-one

Systemtic Name: 2-phenacylsulfanyl-3-phenyl-7-(4-phenylpiperazin-1-yl)carbonyl-quinazolin-4-one Openeye Name: 2-phenacylsulfanyl-3-phenyl-7-(4-phenylpiperazine-1-carbonyl)quinazolin-4-one CAS Name: 7-[oxo-(4-phenyl-1-piperazinyl)methyl]-2-(phenacylthio)-3-phenyl-4-quinazolinone IUPAC Name: 2-phenacylsulfanyl-3-phenyl-7-(4-phenylpiperazine-1-carbonyl)quinazolin-4-one Traditional Name: 2-(phenacylthio)-3-phenyl-7-(4-phenylpiperazine-1-carbonyl)quinazolin-4-one Formula: C33H28N4O3S MolecularWeight: 560.66542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=N4)SCC(=O)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=N4)SCC(=O)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H28N4O3S/c38-30(24-10-4-1-5-11-24)23-41-33-34-29-22-25(16-17-28(29)32(40)37(33)27-14-8-3-9-15-27)31(39)36-20-18-35(19-21-36)26-12-6-2-7-13-26/h1-17,22H,18-21,23H2