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

Systemtic Name: 3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 3-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-N-propargyl-benzenesulfonamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H21N3O3S2/c1-2-12-23-30(27,28)18-7-5-6-17(15-18)22(26)25-13-10-16(11-14-25)21-24-19-8-3-4-9-20(19)29-21/h1,3-9,15-16,23H,10-14H2