N-[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[2-phenyl-5-(p-tolyl)pyrazol-3-yl]acetamide CAS Name: N-[5-(4-methylphenyl)-2-phenyl-3-pyrazolyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[5-(4-methylphenyl)-2-phenylpyrazol-3-yl]acetamide Traditional Name: 2-(benzylthio)-N-[2-phenyl-5-(p-tolyl)pyrazol-3-yl]acetamide Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CSCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CSCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3OS/c1-19-12-14-21(15-13-19)23-16-24(28(27-23)22-10-6-3-7-11-22)26-25(29)18-30-17-20-8-4-2-5-9-20/h2-16H,17-18H2,1H3,(H,26,29)