1-[(5-methylfuran-2-yl)methyl]-4-oxidanylidene-5-[(4S)-4-phenylazepan-1-yl]carbonyl-N-prop-2-enyl-pyridine-3-carboxamide

Systemtic Name: 1-[(5-methylfuran-2-yl)methyl]-4-oxidanylidene-5-[(4S)-4-phenylazepan-1-yl]carbonyl-N-prop-2-enyl-pyridine-3-carboxamide Openeye Name: N-allyl-1-[(5-methyl-2-furyl)methyl]-4-oxo-5-[(4S)-4-phenylazepane-1-carbonyl]pyridine-3-carboxamide CAS Name: 1-[(5-methyl-2-furanyl)methyl]-4-oxo-5-[oxo-[(4S)-4-phenyl-1-azepanyl]methyl]-N-prop-2-enyl-3-pyridinecarboxamide IUPAC Name: 1-[(5-methylfuran-2-yl)methyl]-4-oxo-5-[(4S)-4-phenylazepane-1-carbonyl]-N-prop-2-enylpyridine-3-carboxamide Traditional Name: N-allyl-4-keto-1-[(5-methyl-2-furyl)methyl]-5-[(4S)-4-phenylazepane-1-carbonyl]nicotinamide Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2C=C(C(=O)C(=C2)C(=O)N3CCCC(CC3)C4=CC=CC=C4)C(=O)NCC=C

Isomeric SMILES

CC1=CC=C(O1)CN2C=C(C(=O)C(=C2)C(=O)N3CCC[C@@H](CC3)C4=CC=CC=C4)C(=O)NCC=C

InChI

InChI=1S/C28H31N3O4/c1-3-14-29-27(33)24-18-30(17-23-12-11-20(2)35-23)19-25(26(24)32)28(34)31-15-7-10-22(13-16-31)21-8-5-4-6-9-21/h3-6,8-9,11-12,18-19,22H,1,7,10,13-17H2,2H3,(H,29,33)/t22-/m0/s1