4-cyano-N-[2-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]benzamide

Systemtic Name: 4-cyano-N-[2-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]benzamide Openeye Name: 4-cyano-N-[2-[4-(3-fluorobenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]benzamide CAS Name: 4-cyano-N-[2-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]benzamide IUPAC Name: 4-cyano-N-[2-[4-(3-fluorobenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]benzamide Traditional Name: 4-cyano-N-[2-[4-(3-fluorobenzoyl)piperazino]-5-(piperazine-1-carbonyl)phenyl]benzamide Formula: C30H29FN6O3 MolecularWeight: 540.588063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F)NC(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F)NC(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C30H29FN6O3/c31-25-3-1-2-23(18-25)29(39)37-16-14-35(15-17-37)27-9-8-24(30(40)36-12-10-33-11-13-36)19-26(27)34-28(38)22-6-4-21(20-32)5-7-22/h1-9,18-19,33H,10-17H2,(H,34,38)