N-[5-(3,5-dimethylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[5-(3,5-dimethylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[5-(3,5-dimethylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[5-(3,5-dimethylphenyl)-2-phenyl-3-pyrazolyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[5-(3,5-dimethylphenyl)-2-phenylpyrazol-3-yl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[5-(3,5-dimethylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C28H26N6OS MolecularWeight: 494.61064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NN(C(=C2)NC(=O)CSC3=NN=C(N3C)C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NN(C(=C2)NC(=O)CSC3=NN=C(N3C)C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C28H26N6OS/c1-19-14-20(2)16-22(15-19)24-17-25(34(32-24)23-12-8-5-9-13-23)29-26(35)18-36-28-31-30-27(33(28)3)21-10-6-4-7-11-21/h4-17H,18H2,1-3H3,(H,29,35)