5-azanyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-methylsulfanyl-1-[6-(p-tolyl)pyridazin-3-yl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(4-methylphenyl)-3-pyridazinyl]-3-(methylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(4-methylphenyl)pyridazin-3-yl]-3-methylsulfanylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-(methylthio)-1-[6-(p-tolyl)pyridazin-3-yl]pyrazole-4-carbonitrile Formula: C16H14N6S MolecularWeight: 322.38756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3C(=C(C(=N3)SC)C#N)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3C(=C(C(=N3)SC)C#N)N

InChI

InChI=1S/C16H14N6S/c1-10-3-5-11(6-4-10)13-7-8-14(20-19-13)22-15(18)12(9-17)16(21-22)23-2/h3-8H,18H2,1-2H3