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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-methyl-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-methyl-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-methyl-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-methyl-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-amyl-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C23H30N6O4 MolecularWeight: 454.5221

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)C3=C(N(C(=O)NC3=O)CCCC)N

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)C3=C(N(C(=O)NC3=O)CCCC)N

InChI

InChI=1S/C23H30N6O4/c1-4-6-10-14-29-21(31)16-12-9-8-11-15(16)17(26-29)22(32)27(3)18-19(24)28(13-7-5-2)23(33)25-20(18)30/h8-9,11-12H,4-7,10,13-14,24H2,1-3H3,(H,25,30,33)