N'-[(4-fluorophenyl)methyl]-N'-methoxy-N-(1-methylimidazol-4-yl)sulfonyl-2-oxidanylidene-butanediamide

Systemtic Name: N'-[(4-fluorophenyl)methyl]-N'-methoxy-N-(1-methylimidazol-4-yl)sulfonyl-2-oxidanylidene-butanediamide Openeye Name: N'-[(4-fluorophenyl)methyl]-N'-methoxy-N-(1-methylimidazol-4-yl)sulfonyl-2-oxo-butanediamide CAS Name: N'-[(4-fluorophenyl)methyl]-N'-methoxy-N-[(1-methyl-4-imidazolyl)sulfonyl]-2-oxobutanediamide IUPAC Name: N'-[(4-fluorophenyl)methyl]-N'-methoxy-N-(1-methylimidazol-4-yl)sulfonyl-2-oxobutanediamide Traditional Name: N'-(4-fluorobenzyl)-2-keto-N'-methoxy-N-(1-methylimidazol-4-yl)sulfonyl-succinamide Formula: C16H17FN4O6S MolecularWeight: 412.392783

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)NC(=O)C(=O)CC(=O)N(CC2=CC=C(C=C2)F)OC

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)NC(=O)C(=O)CC(=O)N(CC2=CC=C(C=C2)F)OC

InChI

InChI=1S/C16H17FN4O6S/c1-20-9-14(18-10-20)28(25,26)19-16(24)13(22)7-15(23)21(27-2)8-11-3-5-12(17)6-4-11/h3-6,9-10H,7-8H2,1-2H3,(H,19,24)