1-methyl-4-[4-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[2-(2-oxoazepan-1-yl)acetyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[1-oxo-2-(2-oxo-1-azepanyl)ethyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[2-(2-oxoazepan-1-yl)acetyl]piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 4-[4-[2-(2-ketoazepan-1-yl)acetyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C18H27N5O5S MolecularWeight: 425.50248

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)CN3CCCCCC3=O

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)CN3CCCCCC3=O

InChI

InChI=1S/C18H27N5O5S/c1-20-12-14(11-15(20)18(19)26)29(27,28)23-9-7-21(8-10-23)17(25)13-22-6-4-2-3-5-16(22)24/h11-12H,2-10,13H2,1H3,(H2,19,26)