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

Systemtic Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-(2-cyanoethyl)-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-(2-cyanoethyl)piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C13H19N5O3S MolecularWeight: 325.38666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CCC#N

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CCC#N

InChI

InChI=1S/C13H19N5O3S/c1-16-10-11(9-12(16)13(15)19)22(20,21)18-7-5-17(6-8-18)4-2-3-14/h9-10H,2,4-8H2,1H3,(H2,15,19)