tert-butyl N-[1-(2-cyano-1,2-diazinan-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(2-cyano-1,2-diazinan-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-(2-cyanohexahydropyridazin-1-yl)-2-oxo-ethyl]carbamate CAS Name: N-[1-(2-cyano-1-diazinanyl)-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(2-cyanodiazinan-1-yl)-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-(2-cyanohexahydropyridazin-1-yl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCCCN2C#N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCCCN2C#N

InChI

InChI=1S/C19H26N4O3/c1-19(2,3)26-18(25)21-16(13-15-9-5-4-6-10-15)17(24)23-12-8-7-11-22(23)14-20/h4-6,9-10,16H,7-8,11-13H2,1-3H3,(H,21,25)