N-[3-(azepan-1-ylsulfonyl)phenyl]-6-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-6-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-6-oxo-1H-pyridine-3-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-6-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-6-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-6-keto-1H-pyridine-3-carboxamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CNC(=O)C=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CNC(=O)C=C3

InChI

InChI=1S/C18H21N3O4S/c22-17-9-8-14(13-19-17)18(23)20-15-6-5-7-16(12-15)26(24,25)21-10-3-1-2-4-11-21/h5-9,12-13H,1-4,10-11H2,(H,19,22)(H,20,23)