3-[4-(1-azanylethyl)-5-methyl-pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 3-[4-(1-azanylethyl)-5-methyl-pyrazol-1-yl]benzenecarbonitrile Openeye Name: 3-[4-(1-aminoethyl)-5-methyl-pyrazol-1-yl]benzonitrile CAS Name: 3-[4-(1-aminoethyl)-5-methyl-1-pyrazolyl]benzonitrile IUPAC Name: 3-[4-(1-aminoethyl)-5-methylpyrazol-1-yl]benzonitrile Traditional Name: 3-[4-(1-aminoethyl)-5-methyl-pyrazol-1-yl]benzonitrile Formula: C13H14N4 MolecularWeight: 226.27706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC(=C2)C#N)C(C)N

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC(=C2)C#N)C(C)N

InChI

InChI=1S/C13H14N4/c1-9(15)13-8-16-17(10(13)2)12-5-3-4-11(6-12)7-14/h3-6,8-9H,15H2,1-2H3