phenyl N-(1-cyano-3,3-dimethyl-2-oxidanylidene-butyl)-N-[6-(diethylamino)-2-methyl-pyridin-3-yl]carbamate

Systemtic Name: phenyl N-(1-cyano-3,3-dimethyl-2-oxidanylidene-butyl)-N-[6-(diethylamino)-2-methyl-pyridin-3-yl]carbamate Openeye Name: phenyl N-(1-cyano-3,3-dimethyl-2-oxo-butyl)-N-[6-(diethylamino)-2-methyl-3-pyridyl]carbamate CAS Name: N-(1-cyano-3,3-dimethyl-2-oxobutyl)-N-[6-(diethylamino)-2-methyl-3-pyridinyl]carbamic acid phenyl ester IUPAC Name: phenyl N-(1-cyano-3,3-dimethyl-2-oxobutyl)-N-[6-(diethylamino)-2-methylpyridin-3-yl]carbamate Traditional Name: N-(1-cyano-2-keto-3,3-dimethyl-butyl)-N-[6-(diethylamino)-2-methyl-3-pyridyl]carbamic acid phenyl ester Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=C(C=C1)N(C(C#N)C(=O)C(C)(C)C)C(=O)OC2=CC=CC=C2)C

Isomeric SMILES

CCN(CC)C1=NC(=C(C=C1)N(C(C#N)C(=O)C(C)(C)C)C(=O)OC2=CC=CC=C2)C

InChI

InChI=1S/C24H30N4O3/c1-7-27(8-2)21-15-14-19(17(3)26-21)28(20(16-25)22(29)24(4,5)6)23(30)31-18-12-10-9-11-13-18/h9-15,20H,7-8H2,1-6H3