3-[5-tert-butyl-2-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-5-methylsulfanyl-1,2,4-triazole

Systemtic Name: 3-[5-tert-butyl-2-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-5-methylsulfanyl-1,2,4-triazole Openeye Name: 3-[5-tert-butyl-2-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-5-methylsulfanyl-1,2,4-triazole CAS Name: 3-[5-tert-butyl-2-[(4-fluorophenyl)methyl]-3-pyrazolyl]-4-methyl-5-(methylthio)-1,2,4-triazole IUPAC Name: 3-[5-tert-butyl-2-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-5-methylsulfanyl-1,2,4-triazole Traditional Name: 3-[5-tert-butyl-2-(4-fluorobenzyl)pyrazol-3-yl]-4-methyl-5-(methylthio)-1,2,4-triazole Formula: C18H22FN5S MolecularWeight: 359.464183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C2=NN=C(N2C)SC)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C2=NN=C(N2C)SC)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN5S/c1-18(2,3)15-10-14(16-20-21-17(25-5)23(16)4)24(22-15)11-12-6-8-13(19)9-7-12/h6-10H,11H2,1-5H3