6-azanyl-1-butyl-5-[[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-pentyl-amino]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-butyl-5-[[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-pentyl-amino]pyrimidine-2,4-dione Openeye Name: 6-amino-1-butyl-5-[[3-oxo-3-[4-(2-pyridyl)piperazin-1-yl]propyl]-pentyl-amino]pyrimidine-2,4-dione CAS Name: 6-amino-1-butyl-5-[[3-oxo-3-[4-(2-pyridinyl)-1-piperazinyl]propyl]-pentylamino]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-butyl-5-[[3-oxo-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-pentylamino]pyrimidine-2,4-dione Traditional Name: 6-amino-5-[amyl-[3-keto-3-[4-(2-pyridyl)piperazino]propyl]amino]-1-butyl-pyrimidine-2,4-quinone Formula: C25H39N7O3 MolecularWeight: 485.62226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCC(=O)N1CCN(CC1)C2=CC=CC=N2)C3=C(N(C(=O)NC3=O)CCCC)N

Isomeric SMILES

CCCCCN(CCC(=O)N1CCN(CC1)C2=CC=CC=N2)C3=C(N(C(=O)NC3=O)CCCC)N

InChI

InChI=1S/C25H39N7O3/c1-3-5-9-13-31(22-23(26)32(14-6-4-2)25(35)28-24(22)34)15-11-21(33)30-18-16-29(17-19-30)20-10-7-8-12-27-20/h7-8,10,12H,3-6,9,11,13-19,26H2,1-2H3,(H,28,34,35)