3,5-dimethyl-1-phenyl-4-(phenylsulfanylmethyl)pyrazole

Systemtic Name: 3,5-dimethyl-1-phenyl-4-(phenylsulfanylmethyl)pyrazole Openeye Name: 3,5-dimethyl-1-phenyl-4-(phenylsulfanylmethyl)pyrazole CAS Name: 3,5-dimethyl-1-phenyl-4-[(phenylthio)methyl]pyrazole IUPAC Name: 3,5-dimethyl-1-phenyl-4-(phenylsulfanylmethyl)pyrazole Traditional Name: 3,5-dimethyl-1-phenyl-4-[(phenylthio)methyl]pyrazole Formula: C18H18N2S MolecularWeight: 294.41392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CSC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CSC3=CC=CC=C3

InChI

InChI=1S/C18H18N2S/c1-14-18(13-21-17-11-7-4-8-12-17)15(2)20(19-14)16-9-5-3-6-10-16/h3-12H,13H2,1-2H3