N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-oxidanylidene-N-pentyl-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-oxidanylidene-N-pentyl-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-4-oxo-N-pentyl-3-propyl-phthalazine-1-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-oxo-N-pentyl-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-4-oxo-N-pentyl-3-propylphthalazine-1-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-amyl-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C25H34N6O4 MolecularWeight: 482.57526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CCC

Isomeric SMILES

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CCC

InChI

InChI=1S/C25H34N6O4/c1-4-7-11-16-29(20-21(26)30(15-8-5-2)25(35)27-22(20)32)24(34)19-17-12-9-10-13-18(17)23(33)31(28-19)14-6-3/h9-10,12-13H,4-8,11,14-16,26H2,1-3H3,(H,27,32,35)