3-methyl-4-(3-methylphenyl)-5-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-methyl-4-(3-methylphenyl)-5-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-methyl-4-(m-tolyl)-5-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-methyl-4-(3-methylphenyl)-5-[(1-phenyl-4-pyrazolyl)methylthio]-1,2,4-triazole IUPAC Name: 3-methyl-4-(3-methylphenyl)-5-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-methyl-4-(m-tolyl)-5-[(1-phenylpyrazol-4-yl)methylthio]-1,2,4-triazole Formula: C20H19N5S MolecularWeight: 361.46336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=CN(N=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=CN(N=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C20H19N5S/c1-15-7-6-10-19(11-15)25-16(2)22-23-20(25)26-14-17-12-21-24(13-17)18-8-4-3-5-9-18/h3-13H,14H2,1-2H3