N-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]thiophene-2-sulfonamide

Systemtic Name: N-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]thiophene-2-sulfonamide Openeye Name: N-[3-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-oxo-propyl]thiophene-2-sulfonamide CAS Name: N-[3-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-oxopropyl]-2-thiophenesulfonamide IUPAC Name: N-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxopropyl]thiophene-2-sulfonamide Traditional Name: N-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-3-keto-propyl]thiophene-2-sulfonamide Formula: C19H21N3O3S3 MolecularWeight: 435.58334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCNS(=O)(=O)C2=CC=CS2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CCNS(=O)(=O)C2=CC=CS2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H21N3O3S3/c23-17(9-10-20-28(24,25)18-8-4-12-26-18)22-11-3-5-14(13-22)19-21-15-6-1-2-7-16(15)27-19/h1-2,4,6-8,12,14,20H,3,5,9-11,13H2/t14-/m0/s1