3-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-N-propyl-benzenesulfonamide

Systemtic Name: 3-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-N-propyl-benzenesulfonamide Openeye Name: 3-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-N-propyl-benzenesulfonamide CAS Name: 3-[[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-N-propylbenzenesulfonamide IUPAC Name: 3-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-N-propylbenzenesulfonamide Traditional Name: 3-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-N-propyl-benzenesulfonamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3O3S2/c1-2-12-23-30(27,28)18-9-5-7-16(14-18)22(26)25-13-6-8-17(15-25)21-24-19-10-3-4-11-20(19)29-21/h3-5,7,9-11,14,17,23H,2,6,8,12-13,15H2,1H3