1-[4-(methylamino)phenyl]-5-(4-methylsulfanylphenyl)pyrazole-3-carbonitrile

Systemtic Name: 1-[4-(methylamino)phenyl]-5-(4-methylsulfanylphenyl)pyrazole-3-carbonitrile Openeye Name: 1-[4-(methylamino)phenyl]-5-(4-methylsulfanylphenyl)pyrazole-3-carbonitrile CAS Name: 1-[4-(methylamino)phenyl]-5-[4-(methylthio)phenyl]-3-pyrazolecarbonitrile IUPAC Name: 1-[4-(methylamino)phenyl]-5-(4-methylsulfanylphenyl)pyrazole-3-carbonitrile Traditional Name: 1-[4-(methylamino)phenyl]-5-[4-(methylthio)phenyl]pyrazole-3-carbonitrile Formula: C18H16N4S MolecularWeight: 320.41144

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)N2C(=CC(=N2)C#N)C3=CC=C(C=C3)SC

Isomeric SMILES

CNC1=CC=C(C=C1)N2C(=CC(=N2)C#N)C3=CC=C(C=C3)SC

InChI

InChI=1S/C18H16N4S/c1-20-14-5-7-16(8-6-14)22-18(11-15(12-19)21-22)13-3-9-17(23-2)10-4-13/h3-11,20H,1-2H3