4-[4-[3-(4-fluorophenyl)imidazol-4-yl]carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[3-(4-fluorophenyl)imidazol-4-yl]carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[3-(4-fluorophenyl)imidazole-4-carbonyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[[3-(4-fluorophenyl)-4-imidazolyl]-oxomethyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[3-(4-fluorophenyl)imidazole-4-carbonyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[3-(4-fluorophenyl)imidazole-4-carbonyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C20H21FN6O4S MolecularWeight: 460.481943

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=CN3C4=CC=C(C=C4)F

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=CN3C4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN6O4S/c1-24-12-16(10-17(24)19(22)28)32(30,31)26-8-6-25(7-9-26)20(29)18-11-23-13-27(18)15-4-2-14(21)3-5-15/h2-5,10-13H,6-9H2,1H3,(H2,22,28)