4-[4-[1-(2,3-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[1-(2,3-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[1-(2,3-dimethylphenyl)-5-oxo-pyrrolidine-3-carbonyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[[1-(2,3-dimethylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carbonyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[1-(2,3-dimethylphenyl)-5-keto-pyrrolidine-3-carbonyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C23H29N5O5S MolecularWeight: 487.57186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C)C

InChI

InChI=1S/C23H29N5O5S/c1-15-5-4-6-19(16(15)2)28-13-17(11-21(28)29)23(31)26-7-9-27(10-8-26)34(32,33)18-12-20(22(24)30)25(3)14-18/h4-6,12,14,17H,7-11,13H2,1-3H3,(H2,24,30)