N-(1,3-benzodioxol-5-yl)-1-(1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(1-methyl-4-morpholinosulfonyl-pyrrole-2-carbonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[[1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(1-methyl-4-morpholinosulfonyl-pyrrole-2-carbonyl)isonipecotamide Formula: C23H28N4O7S MolecularWeight: 504.55602

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CN1C=C(C=C1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C23H28N4O7S/c1-25-14-18(35(30,31)27-8-10-32-11-9-27)13-19(25)23(29)26-6-4-16(5-7-26)22(28)24-17-2-3-20-21(12-17)34-15-33-20/h2-3,12-14,16H,4-11,15H2,1H3,(H,24,28)