2-[1,3-benzodioxol-5-ylmethyl-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]sulfonyl-amino]-N-phenyl-ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]sulfonyl-amino]-N-phenyl-ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]sulfonyl-amino]-N-phenyl-acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]sulfonylamino]-N-phenylacetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]sulfonylamino]-N-phenylacetamide Traditional Name: 2-[[4-(4-methylpiperidino)sulfonylphenyl]sulfonyl-piperonyl-amino]-N-phenyl-acetamide Formula: C28H31N3O7S2 MolecularWeight: 585.69164

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC4=C(C=C3)OCO4)CC(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC4=C(C=C3)OCO4)CC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H31N3O7S2/c1-21-13-15-30(16-14-21)39(33,34)24-8-10-25(11-9-24)40(35,36)31(19-28(32)29-23-5-3-2-4-6-23)18-22-7-12-26-27(17-22)38-20-37-26/h2-12,17,21H,13-16,18-20H2,1H3,(H,29,32)