3-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: 3-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-3-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidine-1-carbonyl]benzenesulfonamide CAS Name: 3-[[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 3-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-3-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidine-1-carbonyl]benzenesulfonamide Formula: C22H22ClN3O3S2 MolecularWeight: 476.01138

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCC(CC2)C3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

C=CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCC(CC2)C3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C22H22ClN3O3S2/c1-2-10-24-31(28,29)18-5-3-4-16(13-18)22(27)26-11-8-15(9-12-26)21-25-19-14-17(23)6-7-20(19)30-21/h2-7,13-15,24H,1,8-12H2