N-[2-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[2-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-3,3-dimethyl-butanamide Openeye Name: N-[2-[4-(4-fluorobenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]-3,3-dimethyl-butanamide CAS Name: N-[2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[2-[4-(4-fluorobenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]-3,3-dimethylbutanamide Traditional Name: N-[2-[4-(4-fluorobenzoyl)piperazino]-5-(piperazine-1-carbonyl)phenyl]-3,3-dimethyl-butyramide Formula: C28H36FN5O3 MolecularWeight: 509.615543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCNCC2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCNCC2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H36FN5O3/c1-28(2,3)19-25(35)31-23-18-21(27(37)33-12-10-30-11-13-33)6-9-24(23)32-14-16-34(17-15-32)26(36)20-4-7-22(29)8-5-20/h4-9,18,30H,10-17,19H2,1-3H3,(H,31,35)