N-[1-[4,4-bis(4-fluorophenyl)butylamino]-1-oxidanylidene-propan-2-yl]azepane-1-carboxamide

Systemtic Name: N-[1-[4,4-bis(4-fluorophenyl)butylamino]-1-oxidanylidene-propan-2-yl]azepane-1-carboxamide Openeye Name: N-[2-[4,4-bis(4-fluorophenyl)butylamino]-1-methyl-2-oxo-ethyl]azepane-1-carboxamide CAS Name: N-[1-[4,4-bis(4-fluorophenyl)butylamino]-1-oxopropan-2-yl]-1-azepanecarboxamide IUPAC Name: N-[1-[4,4-bis(4-fluorophenyl)butylamino]-1-oxopropan-2-yl]azepane-1-carboxamide Traditional Name: N-[2-[4,4-bis(4-fluorophenyl)butylamino]-2-keto-1-methyl-ethyl]azepane-1-carboxamide Formula: C26H33F2N3O2 MolecularWeight: 457.555926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)NC(=O)N3CCCCCC3

Isomeric SMILES

CC(C(=O)NCCCC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)NC(=O)N3CCCCCC3

InChI

InChI=1S/C26H33F2N3O2/c1-19(30-26(33)31-17-4-2-3-5-18-31)25(32)29-16-6-7-24(20-8-12-22(27)13-9-20)21-10-14-23(28)15-11-21/h8-15,19,24H,2-7,16-18H2,1H3,(H,29,32)(H,30,33)