N-(4-azanylcyclohexyl)-3-[(4-fluorophenyl)carbonylamino]-4-(4-pyridin-3-ylcarbonylpiperazin-1-yl)benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(4-fluorophenyl)carbonylamino]-4-(4-pyridin-3-ylcarbonylpiperazin-1-yl)benzamide Openeye Name: N-(4-aminocyclohexyl)-3-[(4-fluorobenzoyl)amino]-4-[4-(pyridine-3-carbonyl)piperazin-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-[[(4-fluorophenyl)-oxomethyl]amino]-4-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-[(4-fluorobenzoyl)amino]-4-[4-(pyridine-3-carbonyl)piperazin-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-3-[(4-fluorobenzoyl)amino]-4-(4-nicotinoylpiperazino)benzamide Formula: C30H33FN6O3 MolecularWeight: 544.619823

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CN=CC=C4)NC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CN=CC=C4)NC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C30H33FN6O3/c31-23-6-3-20(4-7-23)28(38)35-26-18-21(29(39)34-25-10-8-24(32)9-11-25)5-12-27(26)36-14-16-37(17-15-36)30(40)22-2-1-13-33-19-22/h1-7,12-13,18-19,24-25H,8-11,14-17,32H2,(H,34,39)(H,35,38)