2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide

Systemtic Name: 2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: 2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide CAS Name: 2-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: 2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: 2-[4-(4-fluorophenyl)sulfonylpiperazino]-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)propionamide Formula: C20H22FN5O4S MolecularWeight: 447.483183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H22FN5O4S/c1-13(19(27)22-15-4-7-17-18(12-15)24-20(28)23-17)25-8-10-26(11-9-25)31(29,30)16-5-2-14(21)3-6-16/h2-7,12-13H,8-11H2,1H3,(H,22,27)(H2,23,24,28)