3-fluoranyl-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]benzamide

Systemtic Name: 3-fluoranyl-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]benzamide Openeye Name: 3-fluoro-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]benzamide CAS Name: 3-fluoro-N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]benzamide IUPAC Name: 3-fluoro-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]benzamide Traditional Name: 3-fluoro-N-[4-(4-p-toluoylpiperazino)-3-(pyrrolidine-1-carbonyl)phenyl]benzamide Formula: C30H31FN4O3 MolecularWeight: 514.590543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC(=CC=C4)F)C(=O)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC(=CC=C4)F)C(=O)N5CCCC5

InChI

InChI=1S/C30H31FN4O3/c1-21-7-9-22(10-8-21)29(37)35-17-15-33(16-18-35)27-12-11-25(20-26(27)30(38)34-13-2-3-14-34)32-28(36)23-5-4-6-24(31)19-23/h4-12,19-20H,2-3,13-18H2,1H3,(H,32,36)