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

Systemtic Name: 1-methyl-4-[4-(2-phenoxyethanoyl)piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-(2-phenoxyacetyl)piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-(1-oxo-2-phenoxyethyl)-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-(2-phenoxyacetyl)piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-(2-phenoxyacetyl)piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C18H22N4O5S/c1-20-12-15(11-16(20)18(19)24)28(25,26)22-9-7-21(8-10-22)17(23)13-27-14-5-3-2-4-6-14/h2-6,11-12H,7-10,13H2,1H3,(H2,19,24)