tert-butyl N-[(Z)-[1-(phenylmethyl)pyrazol-4-yl]methylideneamino]carbamate

Systemtic Name: tert-butyl N-[(Z)-[1-(phenylmethyl)pyrazol-4-yl]methylideneamino]carbamate Openeye Name: tert-butyl N-[(Z)-(1-benzylpyrazol-4-yl)methyleneamino]carbamate CAS Name: N-[(Z)-[1-(phenylmethyl)-4-pyrazolyl]methylideneamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(Z)-(1-benzylpyrazol-4-yl)methylideneamino]carbamate Traditional Name: N-[(Z)-(1-benzylpyrazol-4-yl)methyleneamino]carbamic acid tert-butyl ester Formula: C16H20N4O2 MolecularWeight: 300.3556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN=CC1=CN(N=C1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N/N=C\C1=CN(N=C1)CC2=CC=CC=C2

InChI

InChI=1S/C16H20N4O2/c1-16(2,3)22-15(21)19-17-9-14-10-18-20(12-14)11-13-7-5-4-6-8-13/h4-10,12H,11H2,1-3H3,(H,19,21)/b17-9-