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

Systemtic Name: 1-[4-(methylamino)phenyl]-5-(4-methylsulfinylphenyl)pyrazole-3-carbonitrile Openeye Name: 1-[4-(methylamino)phenyl]-5-(4-methylsulfinylphenyl)pyrazole-3-carbonitrile CAS Name: 1-[4-(methylamino)phenyl]-5-(4-methylsulfinylphenyl)-3-pyrazolecarbonitrile IUPAC Name: 1-[4-(methylamino)phenyl]-5-(4-methylsulfinylphenyl)pyrazole-3-carbonitrile Traditional Name: 1-[4-(methylamino)phenyl]-5-(4-methylsulfinylphenyl)pyrazole-3-carbonitrile Formula: C18H16N4OS MolecularWeight: 336.41084

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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)S(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4OS/c1-20-14-5-7-16(8-6-14)22-18(11-15(12-19)21-22)13-3-9-17(10-4-13)24(2)23/h3-11,20H,1-2H3