N'-(4-fluorophenyl)carbonyl-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbohydrazide

Systemtic Name: N'-(4-fluorophenyl)carbonyl-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbohydrazide Openeye Name: N'-(4-fluorobenzoyl)-4-(p-tolylsulfonyl)-1,4-diazepane-1-carbohydrazide CAS Name: N'-[(4-fluorophenyl)-oxomethyl]-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbohydrazide IUPAC Name: N'-(4-fluorobenzoyl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbohydrazide Traditional Name: N'-(4-fluorobenzoyl)-4-tosyl-1,4-diazepane-1-carbohydrazide Formula: C20H23FN4O4S MolecularWeight: 434.484423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)NNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)NNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H23FN4O4S/c1-15-3-9-18(10-4-15)30(28,29)25-12-2-11-24(13-14-25)20(27)23-22-19(26)16-5-7-17(21)8-6-16/h3-10H,2,11-14H2,1H3,(H,22,26)(H,23,27)