N-[(4S)-2,2-dimethyloxan-4-yl]-6-methyl-4-oxidanylidene-2-phenethyl-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide

Systemtic Name: N-[(4S)-2,2-dimethyloxan-4-yl]-6-methyl-4-oxidanylidene-2-phenethyl-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide Openeye Name: N-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-6-methyl-4-oxo-2-phenethyl-1-(4-pyridylmethyl)pyridine-3-carboxamide CAS Name: N-[(4S)-2,2-dimethyl-4-oxanyl]-6-methyl-4-oxo-2-phenethyl-1-(pyridin-4-ylmethyl)-3-pyridinecarboxamide IUPAC Name: N-[(4S)-2,2-dimethyloxan-4-yl]-6-methyl-4-oxo-2-phenethyl-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide Traditional Name: N-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-4-keto-6-methyl-2-phenethyl-1-(4-pyridylmethyl)nicotinamide Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CC2=CC=NC=C2)CCC3=CC=CC=C3)C(=O)NC4CCOC(C4)(C)C

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC2=CC=NC=C2)CCC3=CC=CC=C3)C(=O)N[C@H]4CCOC(C4)(C)C

InChI

InChI=1S/C28H33N3O3/c1-20-17-25(32)26(27(33)30-23-13-16-34-28(2,3)18-23)24(10-9-21-7-5-4-6-8-21)31(20)19-22-11-14-29-15-12-22/h4-8,11-12,14-15,17,23H,9-10,13,16,18-19H2,1-3H3,(H,30,33)/t23-/m0/s1