3-azanyl-N-(4-azanylcyclohexyl)-4-[4-(6-chloranylpyridin-3-yl)carbonylpiperazin-1-yl]benzamide

Systemtic Name: 3-azanyl-N-(4-azanylcyclohexyl)-4-[4-(6-chloranylpyridin-3-yl)carbonylpiperazin-1-yl]benzamide Openeye Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-(6-chloropyridine-3-carbonyl)piperazin-1-yl]benzamide CAS Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-[(6-chloro-3-pyridinyl)-oxomethyl]-1-piperazinyl]benzamide IUPAC Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-(6-chloropyridine-3-carbonyl)piperazin-1-yl]benzamide Traditional Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-(6-chloronicotinoyl)piperazino]benzamide Formula: C23H29ClN6O2 MolecularWeight: 456.96836

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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=C(C=C4)Cl)N

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CN=C(C=C4)Cl)N

InChI

InChI=1S/C23H29ClN6O2/c24-21-8-2-16(14-27-21)23(32)30-11-9-29(10-12-30)20-7-1-15(13-19(20)26)22(31)28-18-5-3-17(25)4-6-18/h1-2,7-8,13-14,17-18H,3-6,9-12,25-26H2,(H,28,31)