tert-butyl N-(5-cyano-4-methyl-6-oxidanylidene-1-phenyl-pyridazin-3-yl)carbamate

Systemtic Name: tert-butyl N-(5-cyano-4-methyl-6-oxidanylidene-1-phenyl-pyridazin-3-yl)carbamate Openeye Name: tert-butyl N-(5-cyano-4-methyl-6-oxo-1-phenyl-pyridazin-3-yl)carbamate CAS Name: N-(5-cyano-4-methyl-6-oxo-1-phenyl-3-pyridazinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(5-cyano-4-methyl-6-oxo-1-phenylpyridazin-3-yl)carbamate Traditional Name: N-(5-cyano-6-keto-4-methyl-1-phenyl-pyridazin-3-yl)carbamic acid tert-butyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1NC(=O)OC(C)(C)C)C2=CC=CC=C2)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1NC(=O)OC(C)(C)C)C2=CC=CC=C2)C#N

InChI

InChI=1S/C17H18N4O3/c1-11-13(10-18)15(22)21(12-8-6-5-7-9-12)20-14(11)19-16(23)24-17(2,3)4/h5-9H,1-4H3,(H,19,20,23)