1-methyl-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-[(E)-3-phenylacryloyl]piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O4S/c1-21-14-16(13-17(21)19(20)25)28(26,27)23-11-9-22(10-12-23)18(24)8-7-15-5-3-2-4-6-15/h2-8,13-14H,9-12H2,1H3,(H2,20,25)/b8-7+