5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-4-methyl-thiophene-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-4-methyl-thiophene-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]amino]-4-methyl-thiophene-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]amino]-4-methylthiophene-3-carboxamide Traditional Name: 2-[[4-(3,5-dimethylpiperidino)sulfonylbenzoyl]amino]-4-methyl-5-piperonyl-thiophene-3-carboxamide Formula: C28H31N3O6S2 MolecularWeight: 569.69224

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C(=C(S3)CC4=CC5=C(C=C4)OCO5)C)C(=O)N)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C(=C(S3)CC4=CC5=C(C=C4)OCO5)C)C(=O)N)C

InChI

InChI=1S/C28H31N3O6S2/c1-16-10-17(2)14-31(13-16)39(34,35)21-7-5-20(6-8-21)27(33)30-28-25(26(29)32)18(3)24(38-28)12-19-4-9-22-23(11-19)37-15-36-22/h4-9,11,16-17H,10,12-15H2,1-3H3,(H2,29,32)(H,30,33)