3-(4-methylphenyl)-N-(3-methylsulfanylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 3-(4-methylphenyl)-N-(3-methylsulfanylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3-methylsulfanylphenyl)-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: 3-(4-methylphenyl)-N-[3-(methylthio)phenyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(4-methylphenyl)-N-(3-methylsulfanylphenyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[3-(methylthio)phenyl]-3-(p-tolyl)pyrazole-4-carboxamide Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=CC=C3)SC)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=CC=C3)SC)CC4=CC=CC=C4

InChI

InChI=1S/C25H23N3OS/c1-18-11-13-20(14-12-18)24-23(17-28(27-24)16-19-7-4-3-5-8-19)25(29)26-21-9-6-10-22(15-21)30-2/h3-15,17H,16H2,1-2H3,(H,26,29)