N-[5-[[3-(aminomethyl)cyclohexyl]methylcarbamoyl]-2-methyl-phenyl]-6-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-[5-[[3-(aminomethyl)cyclohexyl]methylcarbamoyl]-2-methyl-phenyl]-6-chloranyl-pyridine-3-carboxamide Openeye Name: N-[5-[[3-(aminomethyl)cyclohexyl]methylcarbamoyl]-2-methyl-phenyl]-6-chloro-pyridine-3-carboxamide CAS Name: N-[5-[[[3-(aminomethyl)cyclohexyl]methylamino]-oxomethyl]-2-methylphenyl]-6-chloro-3-pyridinecarboxamide IUPAC Name: N-[5-[[3-(aminomethyl)cyclohexyl]methylcarbamoyl]-2-methylphenyl]-6-chloropyridine-3-carboxamide Traditional Name: N-[5-[[3-(aminomethyl)cyclohexyl]methylcarbamoyl]-2-methyl-phenyl]-6-chloro-nicotinamide Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2CCCC(C2)CN)NC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2CCCC(C2)CN)NC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN4O2/c1-14-5-6-17(21(28)26-12-16-4-2-3-15(9-16)11-24)10-19(14)27-22(29)18-7-8-20(23)25-13-18/h5-8,10,13,15-16H,2-4,9,11-12,24H2,1H3,(H,26,28)(H,27,29)