5-azanyl-1-phenyl-3-phenylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-phenyl-3-phenylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-phenyl-3-phenylsulfanyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-phenyl-3-(phenylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-phenyl-3-phenylsulfanylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-phenyl-3-(phenylthio)pyrazole-4-carbonitrile Formula: C16H12N4S MolecularWeight: 292.35828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)SC3=CC=CC=C3)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)SC3=CC=CC=C3)C#N)N

InChI

InChI=1S/C16H12N4S/c17-11-14-15(18)20(12-7-3-1-4-8-12)19-16(14)21-13-9-5-2-6-10-13/h1-10H,18H2