N-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]phenyl]thiophene-2-sulfonamide

Systemtic Name: N-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]phenyl]thiophene-2-sulfonamide Openeye Name: N-[4-[2-(azepan-1-yl)-2-oxo-ethyl]phenyl]thiophene-2-sulfonamide CAS Name: N-[4-[2-(1-azepanyl)-2-oxoethyl]phenyl]-2-thiophenesulfonamide IUPAC Name: N-[4-[2-(azepan-1-yl)-2-oxoethyl]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[2-(azepan-1-yl)-2-keto-ethyl]phenyl]thiophene-2-sulfonamide Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CCCN(CC1)C(=O)CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H22N2O3S2/c21-17(20-11-3-1-2-4-12-20)14-15-7-9-16(10-8-15)19-25(22,23)18-6-5-13-24-18/h5-10,13,19H,1-4,11-12,14H2