[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-phenyl]methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-phenyl]methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)-1-piperidyl]-[2-methyl-5-[(2-methyl-1-piperidyl)sulfonyl]phenyl]methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[2-methyl-5-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[2-methyl-5-(2-methylpiperidin-1-yl)sulfonylphenyl]methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperidino]-[2-methyl-5-(2-methylpiperidino)sulfonyl-phenyl]methanone Formula: C26H31N3O3S2 MolecularWeight: 497.67264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H31N3O3S2/c1-18-10-11-21(34(31,32)29-14-6-5-7-19(29)2)17-22(18)26(30)28-15-12-20(13-16-28)25-27-23-8-3-4-9-24(23)33-25/h3-4,8-11,17,19-20H,5-7,12-16H2,1-2H3