1-methyl-4-[4-(4-methyl-3-pyrrol-1-yl-phenyl)carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-(4-methyl-3-pyrrol-1-yl-phenyl)carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-(4-methyl-3-pyrrol-1-yl-benzoyl)piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[[4-methyl-3-(1-pyrrolyl)phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-(4-methyl-3-pyrrol-1-ylbenzoyl)piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-(4-methyl-3-pyrrol-1-yl-benzoyl)piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C)N4C=CC=C4

InChI

InChI=1S/C22H25N5O4S/c1-16-5-6-17(13-19(16)25-7-3-4-8-25)22(29)26-9-11-27(12-10-26)32(30,31)18-14-20(21(23)28)24(2)15-18/h3-8,13-15H,9-12H2,1-2H3,(H2,23,28)