ethanoyl 2-[5-azanyl-6-methyl-2,7-bis(phenylmethyl)pyrrolo[1,2-b]pyridazin-3-yl]-2-oxidanylidene-ethanoate

Systemtic Name: ethanoyl 2-[5-azanyl-6-methyl-2,7-bis(phenylmethyl)pyrrolo[1,2-b]pyridazin-3-yl]-2-oxidanylidene-ethanoate Openeye Name: acetyl 2-(5-amino-2,7-dibenzyl-6-methyl-pyrrolo[1,2-b]pyridazin-3-yl)-2-oxo-acetate CAS Name: 2-[5-amino-6-methyl-2,7-bis(phenylmethyl)-3-pyrrolo[1,2-b]pyridazinyl]-2-oxoacetic acid acetyl ester IUPAC Name: acetyl 2-(5-amino-2,7-dibenzyl-6-methylpyrrolo[1,2-b]pyridazin-3-yl)-2-oxoacetate Traditional Name: 2-(5-amino-2,7-dibenzyl-6-methyl-pyrrolo[1,2-b]pyridazin-3-yl)-2-keto-acetic acid acetyl ester Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=C1N)C=C(C(=N2)CC3=CC=CC=C3)C(=O)C(=O)OC(=O)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N2C(=C1N)C=C(C(=N2)CC3=CC=CC=C3)C(=O)C(=O)OC(=O)C)CC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O4/c1-16-22(14-19-11-7-4-8-12-19)29-23(24(16)27)15-20(25(31)26(32)33-17(2)30)21(28-29)13-18-9-5-3-6-10-18/h3-12,15H,13-14,27H2,1-2H3