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

Systemtic Name: 1-methyl-4-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[2-(4-pyridyl)ethyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-(2-pyridin-4-ylethyl)-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-[2-(4-pyridyl)ethyl]piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CCC3=CC=NC=C3

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CCC3=CC=NC=C3

InChI

InChI=1S/C17H23N5O3S/c1-20-13-15(12-16(20)17(18)23)26(24,25)22-10-8-21(9-11-22)7-4-14-2-5-19-6-3-14/h2-3,5-6,12-13H,4,7-11H2,1H3,(H2,18,23)