N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide Formula: C17H23N3O3S2 MolecularWeight: 381.51282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(C)CC(=O)N3CCCCCC3

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(C)CC(=O)N3CCCCCC3

InChI

InChI=1S/C17H23N3O3S2/c1-13-18-15-8-7-14(11-16(15)24-13)25(22,23)19(2)12-17(21)20-9-5-3-4-6-10-20/h7-8,11H,3-6,9-10,12H2,1-2H3