N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(5-bromo-2-oxo-1-pyridyl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(5-bromo-2-oxo-1-pyridinyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(5-bromo-2-oxopyridin-1-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(5-bromo-2-keto-1-pyridyl)acetamide Formula: C19H22BrN3O4S MolecularWeight: 468.36468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3C=C(C=CC3=O)Br

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3C=C(C=CC3=O)Br

InChI

InChI=1S/C19H22BrN3O4S/c20-15-8-9-19(25)22(13-15)14-18(24)21-16-6-5-7-17(12-16)28(26,27)23-10-3-1-2-4-11-23/h5-9,12-13H,1-4,10-11,14H2,(H,21,24)