2-[1-[2,5-diethoxy-4-(4-methylpiperidin-1-yl)sulfonyl-phenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-[2,5-diethoxy-4-(4-methylpiperidin-1-yl)sulfonyl-phenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-[2,5-diethoxy-4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]sulfonyl-4-piperidyl]-1,3-benzothiazole CAS Name: 2-[1-[2,5-diethoxy-4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]sulfonyl-4-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[1-[2,5-diethoxy-4-(4-methylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole Traditional Name: 2-[1-[2,5-diethoxy-4-(4-methylpiperidino)sulfonyl-phenyl]sulfonyl-4-piperidyl]-1,3-benzothiazole Formula: C28H37N3O6S3 MolecularWeight: 607.80488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1S(=O)(=O)N2CCC(CC2)C)OCC)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCOC1=CC(=C(C=C1S(=O)(=O)N2CCC(CC2)C)OCC)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C28H37N3O6S3/c1-4-36-23-19-27(24(37-5-2)18-26(23)39(32,33)30-14-10-20(3)11-15-30)40(34,35)31-16-12-21(13-17-31)28-29-22-8-6-7-9-25(22)38-28/h6-9,18-21H,4-5,10-17H2,1-3H3