5-[(3-methoxyphenyl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-[(3-methoxyphenyl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-[(3-methoxyphenyl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-[[(3-methoxyphenyl)thio]methyl]-3-methyl-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-[(3-methoxyphenyl)sulfanylmethyl]-3-methyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-[[(3-methoxyphenyl)thio]methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Formula: C19H17N3OS MolecularWeight: 335.42278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)CSC2=CC=CC(=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)CSC2=CC=CC(=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3OS/c1-14-18(12-20)19(22(21-14)15-7-4-3-5-8-15)13-24-17-10-6-9-16(11-17)23-2/h3-11H,13H2,1-2H3