5-(2,5-dimethylpyrrol-1-yl)-3-ethyl-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-(2,5-dimethylpyrrol-1-yl)-3-ethyl-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-(2,5-dimethylpyrrol-1-yl)-3-ethyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-(2,5-dimethyl-1-pyrrolyl)-3-ethyl-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-(2,5-dimethylpyrrol-1-yl)-3-ethyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-(2,5-dimethylpyrrol-1-yl)-3-ethyl-1-phenyl-pyrazole-4-carbonitrile Formula: C18H18N4 MolecularWeight: 290.36232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C#N)N2C(=CC=C2C)C)C3=CC=CC=C3

Isomeric SMILES

CCC1=NN(C(=C1C#N)N2C(=CC=C2C)C)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4/c1-4-17-16(12-19)18(21-13(2)10-11-14(21)3)22(20-17)15-8-6-5-7-9-15/h5-11H,4H2,1-3H3