(phenylmethyl) N-[[1-(2-cyano-1,2-diazinan-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]amino]carbamate

Systemtic Name: (phenylmethyl) N-[[1-(2-cyano-1,2-diazinan-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]amino]carbamate Openeye Name: benzyl N-[[1-(2-cyanohexahydropyridazine-1-carbonyl)-2-methyl-propyl]amino]carbamate CAS Name: N-[[1-(2-cyano-1-diazinanyl)-3-methyl-1-oxobutan-2-yl]amino]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[[1-(2-cyanodiazinan-1-yl)-3-methyl-1-oxobutan-2-yl]amino]carbamate Traditional Name: N-[[1-(2-cyanohexahydropyridazine-1-carbonyl)-2-methyl-propyl]amino]carbamic acid benzyl ester Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCCN1C#N)NNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)N1CCCCN1C#N)NNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25N5O3/c1-14(2)16(17(24)23-11-7-6-10-22(23)13-19)20-21-18(25)26-12-15-8-4-3-5-9-15/h3-5,8-9,14,16,20H,6-7,10-12H2,1-2H3,(H,21,25)