3-(4-tert-butylphenyl)-5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazole

Systemtic Name: 3-(4-tert-butylphenyl)-5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-(4-tert-butylphenyl)-5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-5-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-5-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-(4-tert-butylphenyl)-5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-4-methyl-1,2,4-triazole Formula: C24H26ClN5S MolecularWeight: 452.01474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NN=C(N2C)C3=CC=C(C=C3)C(C)(C)C)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1CSC2=NN=C(N2C)C3=CC=C(C=C3)C(C)(C)C)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H26ClN5S/c1-16-20(21(25)30(28-16)19-9-7-6-8-10-19)15-31-23-27-26-22(29(23)5)17-11-13-18(14-12-17)24(2,3)4/h6-14H,15H2,1-5H3