N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-1-(4-fluorobenzoyl)isonipecotamide Formula: C25H34FN5O4 MolecularWeight: 487.566963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)N

InChI

InChI=1S/C25H34FN5O4/c1-3-5-13-30(20-21(27)31(14-6-4-2)25(35)28-22(20)32)24(34)18-11-15-29(16-12-18)23(33)17-7-9-19(26)10-8-17/h7-10,18H,3-6,11-16,27H2,1-2H3,(H,28,32,35)