N-[3-(azepan-1-ylsulfonyl)phenyl]-3-methyl-but-2-enamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-methyl-but-2-enamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-methyl-but-2-enamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-3-methyl-2-butenamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-methylbut-2-enamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-methyl-but-2-enamide Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)C

Isomeric SMILES

CC(=CC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)C

InChI

InChI=1S/C17H24N2O3S/c1-14(2)12-17(20)18-15-8-7-9-16(13-15)23(21,22)19-10-5-3-4-6-11-19/h7-9,12-13H,3-6,10-11H2,1-2H3,(H,18,20)