5-(azepan-1-ylcarbonyl)-1-(2-methylpropyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1-(2-methylpropyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-1-isobutyl-N-[(4-methylthiazol-2-yl)methyl]-4-oxo-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-1-(2-methylpropyl)-N-[(4-methyl-2-thiazolyl)methyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-1-(2-methylpropyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-oxopyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-1-isobutyl-4-keto-N-[(4-methylthiazol-2-yl)methyl]nicotinamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)CNC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCCC3)CC(C)C

Isomeric SMILES

CC1=CSC(=N1)CNC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCCC3)CC(C)C

InChI

InChI=1S/C22H30N4O3S/c1-15(2)11-25-12-17(21(28)23-10-19-24-16(3)14-30-19)20(27)18(13-25)22(29)26-8-6-4-5-7-9-26/h12-15H,4-11H2,1-3H3,(H,23,28)