N-cyclopropyl-2-[2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]ethanoylamino]benzamide

Systemtic Name: N-cyclopropyl-2-[2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]acetyl]amino]benzamide Formula: C23H27FN4O4S MolecularWeight: 474.548283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)CC(=O)NC3=CC=CC=C3C(=O)NC4CC4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)CC(=O)NC3=CC=CC=C3C(=O)NC4CC4

InChI

InChI=1S/C23H27FN4O4S/c24-17-6-10-19(11-7-17)33(31,32)28-13-3-12-27(14-15-28)16-22(29)26-21-5-2-1-4-20(21)23(30)25-18-8-9-18/h1-2,4-7,10-11,18H,3,8-9,12-16H2,(H,25,30)(H,26,29)