2-[1-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]sulfonyl-4-piperidyl]-1,3-benzothiazole CAS Name: 2-[1-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]sulfonyl-4-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[1-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole Traditional Name: 2-[1-[4-(3,5-dimethylpiperidino)sulfonylphenyl]sulfonyl-4-piperidyl]-1,3-benzothiazole Formula: C25H31N3O4S3 MolecularWeight: 533.72634

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C25H31N3O4S3/c1-18-15-19(2)17-28(16-18)35(31,32)22-9-7-21(8-10-22)34(29,30)27-13-11-20(12-14-27)25-26-23-5-3-4-6-24(23)33-25/h3-10,18-20H,11-17H2,1-2H3