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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)N

InChI

InChI=1S/C25H34N6O4/c1-6-7-13-30-21(26)20(22(32)27-25(30)35)29(14-12-15(2)3)24(34)19-17-10-8-9-11-18(17)23(33)31(28-19)16(4)5/h8-11,15-16H,6-7,12-14,26H2,1-5H3,(H,27,32,35)