[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone

Systemtic Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Openeye Name: [3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone CAS Name: [3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone IUPAC Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Traditional Name: [3-(1,3-benzothiazol-2-yl)piperidino]-(2-mesyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H25N3O3S2/c1-31(28,29)26-15-17-8-3-2-7-16(17)13-20(26)23(27)25-12-6-9-18(14-25)22-24-19-10-4-5-11-21(19)30-22/h2-5,7-8,10-11,18,20H,6,9,12-15H2,1H3