4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[(6-fluoranyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)methyl]butanamide

Systemtic Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[(6-fluoranyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)methyl]butanamide Openeye Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[(6-fluoro-4-oxo-3-phenyl-quinazolin-2-yl)methyl]butanamide CAS Name: 4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-N-[(6-fluoro-4-oxo-3-phenyl-2-quinazolinyl)methyl]butanamide IUPAC Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[(6-fluoro-4-oxo-3-phenylquinazolin-2-yl)methyl]butanamide Traditional Name: 4-[4-(2,3-dimethylphenyl)piperazino]-N-[(6-fluoro-4-keto-3-phenyl-quinazolin-2-yl)methyl]butyramide Formula: C31H34FN5O2 MolecularWeight: 527.632363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)CCCC(=O)NCC3=NC4=C(C=C(C=C4)F)C(=O)N3C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)CCCC(=O)NCC3=NC4=C(C=C(C=C4)F)C(=O)N3C5=CC=CC=C5)C

InChI

InChI=1S/C31H34FN5O2/c1-22-8-6-11-28(23(22)2)36-18-16-35(17-19-36)15-7-12-30(38)33-21-29-34-27-14-13-24(32)20-26(27)31(39)37(29)25-9-4-3-5-10-25/h3-6,8-11,13-14,20H,7,12,15-19,21H2,1-2H3,(H,33,38)