[4-(4-fluorophenyl)piperazin-1-yl]-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]methanone

Systemtic Name: [4-(4-fluorophenyl)piperazin-1-yl]-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]methanone Openeye Name: [4-(4-fluorophenyl)piperazin-1-yl]-[4-[[(2-thioxo-1H-quinazolin-4-yl)amino]methyl]phenyl]methanone CAS Name: [4-(4-fluorophenyl)-1-piperazinyl]-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]methanone IUPAC Name: [4-(4-fluorophenyl)piperazin-1-yl]-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]methanone Traditional Name: [4-(4-fluorophenyl)piperazino]-[4-[[(2-thioxo-1H-quinazolin-4-yl)amino]methyl]phenyl]methanone Formula: C26H24FN5OS MolecularWeight: 473.565063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)CNC4=NC(=S)NC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)CNC4=NC(=S)NC5=CC=CC=C54

InChI

InChI=1S/C26H24FN5OS/c27-20-9-11-21(12-10-20)31-13-15-32(16-14-31)25(33)19-7-5-18(6-8-19)17-28-24-22-3-1-2-4-23(22)29-26(34)30-24/h1-12H,13-17H2,(H2,28,29,30,34)