ethyl N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylideneamino]carbamate

Systemtic Name: ethyl N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylideneamino]carbamate Openeye Name: ethyl N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methyleneamino]carbamate CAS Name: N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-4-pyrazolyl]methylideneamino]carbamic acid ethyl ester IUPAC Name: ethyl N-[(Z)-[1-(2-cyanoethyl)-3-phenylpyrazol-4-yl]methylideneamino]carbamate Traditional Name: N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methyleneamino]carbamic acid ethyl ester Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NN=CC1=CN(N=C1C2=CC=CC=C2)CCC#N

Isomeric SMILES

CCOC(=O)N/N=C\C1=CN(N=C1C2=CC=CC=C2)CCC#N

InChI

InChI=1S/C16H17N5O2/c1-2-23-16(22)19-18-11-14-12-21(10-6-9-17)20-15(14)13-7-4-3-5-8-13/h3-5,7-8,11-12H,2,6,10H2,1H3,(H,19,22)/b18-11-