N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-4-ethanoyl-benzenesulfonamide

Systemtic Name: N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-4-ethanoyl-benzenesulfonamide Openeye Name: 4-acetyl-N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: 4-acetyl-N-[3-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-3-keto-propyl]benzenesulfonamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N2CCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N2CCCC2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O4S2/c1-15(26)16-8-10-17(11-9-16)31(28,29)23-13-12-21(27)25-14-4-6-19(25)22-24-18-5-2-3-7-20(18)30-22/h2-3,5,7-11,19,23H,4,6,12-14H2,1H3