4-(azepan-1-ylsulfonyl)-N-[2-(ethylamino)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[2-(ethylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[2-(ethylamino)-2-oxo-ethyl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[2-(ethylamino)-2-oxoethyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[2-(ethylamino)-2-oxoethyl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[2-(ethylamino)-2-keto-ethyl]benzamide Formula: C17H25N3O4S MolecularWeight: 367.4631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCNC(=O)CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C17H25N3O4S/c1-2-18-16(21)13-19-17(22)14-7-9-15(10-8-14)25(23,24)20-11-5-3-4-6-12-20/h7-10H,2-6,11-13H2,1H3,(H,18,21)(H,19,22)