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

Systemtic Name: N-[3-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]thiophene-2-sulfonamide Openeye Name: N-[3-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxo-propyl]thiophene-2-sulfonamide CAS Name: N-[3-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-3-oxopropyl]-2-thiophenesulfonamide IUPAC Name: N-[3-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxopropyl]thiophene-2-sulfonamide Traditional Name: N-[3-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-3-keto-propyl]thiophene-2-sulfonamide Formula: C18H19N3O3S3 MolecularWeight: 421.55676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O3S3/c22-16(9-10-19-27(23,24)17-8-4-12-25-17)21-11-3-6-14(21)18-20-13-5-1-2-7-15(13)26-18/h1-2,4-5,7-8,12,14,19H,3,6,9-11H2/t14-/m1/s1