tert-butyl N-[[4-[(5-azanyl-4-cyano-1H-pyrazol-3-yl)amino]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[(5-azanyl-4-cyano-1H-pyrazol-3-yl)amino]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[(5-amino-4-cyano-1H-pyrazol-3-yl)amino]phenyl]methyl]carbamate CAS Name: N-[[4-[(5-amino-4-cyano-1H-pyrazol-3-yl)amino]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[(5-amino-4-cyano-1H-pyrazol-3-yl)amino]phenyl]methyl]carbamate Traditional Name: N-[4-[(5-amino-4-cyano-1H-pyrazol-3-yl)amino]benzyl]carbamic acid tert-butyl ester Formula: C16H20N6O2 MolecularWeight: 328.369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)NC2=NNC(=C2C#N)N

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)NC2=NNC(=C2C#N)N

InChI

InChI=1S/C16H20N6O2/c1-16(2,3)24-15(23)19-9-10-4-6-11(7-5-10)20-14-12(8-17)13(18)21-22-14/h4-7H,9H2,1-3H3,(H,19,23)(H4,18,20,21,22)