[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)-1-piperidyl]-[4-(methylsulfonylmethyl)phenyl]methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[4-(methylsulfonylmethyl)phenyl]methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperidino]-[4-(mesylmethyl)phenyl]methanone Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N2O3S2/c1-28(25,26)14-15-6-8-17(9-7-15)21(24)23-12-10-16(11-13-23)20-22-18-4-2-3-5-19(18)27-20/h2-9,16H,10-14H2,1H3