N-[1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-pentan-2-yl]azepane-1-carboxamide

Systemtic Name: N-[1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-pentan-2-yl]azepane-1-carboxamide Openeye Name: N-[1-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]-2-methyl-butyl]azepane-1-carboxamide CAS Name: N-[1-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-3-methyl-1-oxopentan-2-yl]-1-azepanecarboxamide IUPAC Name: N-[1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxopentan-2-yl]azepane-1-carboxamide Traditional Name: N-[1-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]-2-methyl-butyl]azepane-1-carboxamide Formula: C30H40F2N4O2 MolecularWeight: 526.661006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)NC(=O)N4CCCCCC4

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)NC(=O)N4CCCCCC4

InChI

InChI=1S/C30H40F2N4O2/c1-3-22(2)27(33-30(38)36-16-6-4-5-7-17-36)29(37)35-20-18-34(19-21-35)28(23-8-12-25(31)13-9-23)24-10-14-26(32)15-11-24/h8-15,22,27-28H,3-7,16-21H2,1-2H3,(H,33,38)