3-phenyl-1-[4-(4-phenylpiperazin-1-yl)quinazolin-2-yl]-2-sulfanylidene-quinazolin-4-one

Systemtic Name: 3-phenyl-1-[4-(4-phenylpiperazin-1-yl)quinazolin-2-yl]-2-sulfanylidene-quinazolin-4-one Openeye Name: 3-phenyl-1-[4-(4-phenylpiperazin-1-yl)quinazolin-2-yl]-2-thioxo-quinazolin-4-one CAS Name: 3-phenyl-1-[4-(4-phenyl-1-piperazinyl)-2-quinazolinyl]-2-sulfanylidene-4-quinazolinone IUPAC Name: 3-phenyl-1-[4-(4-phenylpiperazin-1-yl)quinazolin-2-yl]-2-sulfanylidenequinazolin-4-one Traditional Name: 3-phenyl-1-[4-(4-phenylpiperazino)quinazolin-2-yl]-2-thioxo-quinazolin-4-one Formula: C32H26N6OS MolecularWeight: 542.65344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)N5C6=CC=CC=C6C(=O)N(C5=S)C7=CC=CC=C7

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)N5C6=CC=CC=C6C(=O)N(C5=S)C7=CC=CC=C7

InChI

InChI=1S/C32H26N6OS/c39-30-26-16-8-10-18-28(26)38(32(40)37(30)24-13-5-2-6-14-24)31-33-27-17-9-7-15-25(27)29(34-31)36-21-19-35(20-22-36)23-11-3-1-4-12-23/h1-18H,19-22H2