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

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)-1-piperidyl]-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperidino]-(2-esyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Formula: C24H27N3O3S2 MolecularWeight: 469.61948

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H27N3O3S2/c1-2-32(29,30)27-16-19-8-4-3-7-18(19)15-21(27)24(28)26-13-11-17(12-14-26)23-25-20-9-5-6-10-22(20)31-23/h3-10,17,21H,2,11-16H2,1H3