N-(1-adamantylmethyl)-5-(azepan-1-ylcarbonyl)-1-[(2S)-butan-2-yl]-N-methyl-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-5-(azepan-1-ylcarbonyl)-1-[(2S)-butan-2-yl]-N-methyl-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-5-(azepane-1-carbonyl)-N-methyl-1-[(1S)-1-methylpropyl]-4-oxo-pyridine-3-carboxamide CAS Name: N-(1-adamantylmethyl)-5-[1-azepanyl(oxo)methyl]-1-[(2S)-butan-2-yl]-N-methyl-4-oxo-3-pyridinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-5-(azepane-1-carbonyl)-1-[(2S)-butan-2-yl]-N-methyl-4-oxopyridine-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-5-(azepane-1-carbonyl)-4-keto-N-methyl-1-[(1S)-1-methylpropyl]nicotinamide Formula: C29H43N3O3 MolecularWeight: 481.67002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N(C)CC23CC4CC(C2)CC(C4)C3)C(=O)N5CCCCCC5

Isomeric SMILES

CC[C@H](C)N1C=C(C(=O)C(=C1)C(=O)N(C)CC23CC4CC(C2)CC(C4)C3)C(=O)N5CCCCCC5

InChI

InChI=1S/C29H43N3O3/c1-4-20(2)32-17-24(26(33)25(18-32)28(35)31-9-7-5-6-8-10-31)27(34)30(3)19-29-14-21-11-22(15-29)13-23(12-21)16-29/h17-18,20-23H,4-16,19H2,1-3H3/t20-,21?,22?,23?,29?/m0/s1