methyl 4-(4-ethylpiperazin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-(4-ethylpiperazin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-(4-ethylpiperazin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(4-ethyl-1-piperazinyl)sulfonyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethylpiperazin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(4-ethylpiperazino)sulfonyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C12H19N3O4S MolecularWeight: 301.36196

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)OC

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)OC

InChI

InChI=1S/C12H19N3O4S/c1-3-14-4-6-15(7-5-14)20(17,18)10-8-11(13-9-10)12(16)19-2/h8-9,13H,3-7H2,1-2H3