[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-methylsulfonylphenyl)methanone

Systemtic Name: [2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-methylsulfonylphenyl)methanone Openeye Name: [2-(1,3-benzothiazol-2-yl)-1-piperidyl]-(3-methylsulfonylphenyl)methanone CAS Name: [2-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(3-methylsulfonylphenyl)methanone IUPAC Name: [2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-methylsulfonylphenyl)methanone Traditional Name: [2-(1,3-benzothiazol-2-yl)piperidino]-(3-mesylphenyl)methanone Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCCC2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20N2O3S2/c1-27(24,25)15-8-6-7-14(13-15)20(23)22-12-5-4-10-17(22)19-21-16-9-2-3-11-18(16)26-19/h2-3,6-9,11,13,17H,4-5,10,12H2,1H3