N-(1-adamantylmethyl)-5-chloranyl-2-[3-[(4-methylcyclohexyl)amino]propyl]pyridine-4-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-5-chloranyl-2-[3-[(4-methylcyclohexyl)amino]propyl]pyridine-4-carboxamide Openeye Name: N-(1-adamantylmethyl)-5-chloro-2-[3-[(4-methylcyclohexyl)amino]propyl]pyridine-4-carboxamide CAS Name: N-(1-adamantylmethyl)-5-chloro-2-[3-[(4-methylcyclohexyl)amino]propyl]-4-pyridinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-5-chloro-2-[3-[(4-methylcyclohexyl)amino]propyl]pyridine-4-carboxamide Traditional Name: N-(1-adamantylmethyl)-5-chloro-2-[3-[(4-methylcyclohexyl)amino]propyl]isonicotinamide Formula: C27H40ClN3O MolecularWeight: 458.079

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NCCCC2=NC=C(C(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

CC1CCC(CC1)NCCCC2=NC=C(C(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C27H40ClN3O/c1-18-4-6-22(7-5-18)29-8-2-3-23-12-24(25(28)16-30-23)26(32)31-17-27-13-19-9-20(14-27)11-21(10-19)15-27/h12,16,18-22,29H,2-11,13-15,17H2,1H3,(H,31,32)