6-azanyl-N-(2-azanyl-2-oxidanylidene-ethyl)-6-[(4-nitrophenyl)methyl]-5-oxidanylidene-1-propan-2-yl-7,8-dihydro-1H-pyrazolo[1,2-a]pyridazine-3-carboxamide

Systemtic Name: 6-azanyl-N-(2-azanyl-2-oxidanylidene-ethyl)-6-[(4-nitrophenyl)methyl]-5-oxidanylidene-1-propan-2-yl-7,8-dihydro-1H-pyrazolo[1,2-a]pyridazine-3-carboxamide Openeye Name: 6-amino-N-(2-amino-2-oxo-ethyl)-1-isopropyl-6-[(4-nitrophenyl)methyl]-5-oxo-7,8-dihydro-1H-pyrazolo[1,2-a]pyridazine-3-carboxamide CAS Name: 6-amino-N-(2-amino-2-oxoethyl)-6-[(4-nitrophenyl)methyl]-5-oxo-1-propan-2-yl-7,8-dihydro-1H-pyrazolo[1,2-a]pyridazine-3-carboxamide IUPAC Name: 6-amino-N-(2-amino-2-oxoethyl)-6-[(4-nitrophenyl)methyl]-5-oxo-1-propan-2-yl-7,8-dihydro-1H-pyrazolo[1,2-a]pyridazine-3-carboxamide Traditional Name: 6-amino-N-(2-amino-2-keto-ethyl)-1-isopropyl-5-keto-6-(4-nitrobenzyl)-7,8-dihydro-1H-pyrazolo[1,2-a]pyridazine-3-carboxamide Formula: C20H26N6O5 MolecularWeight: 430.45764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C=C(N2N1CCC(C2=O)(CC3=CC=C(C=C3)[N+](=O)[O-])N)C(=O)NCC(=O)N

Isomeric SMILES

CC(C)C1C=C(N2N1CCC(C2=O)(CC3=CC=C(C=C3)[N+](=O)[O-])N)C(=O)NCC(=O)N

InChI

InChI=1S/C20H26N6O5/c1-12(2)15-9-16(18(28)23-11-17(21)27)25-19(29)20(22,7-8-24(15)25)10-13-3-5-14(6-4-13)26(30)31/h3-6,9,12,15H,7-8,10-11,22H2,1-2H3,(H2,21,27)(H,23,28)