3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole

Systemtic Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole Openeye Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole CAS Name: 3-[(2,5-dimethylphenyl)methylthio]-5-(3-methoxy-1-methyl-4-pyrazolyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(3-methoxy-1-methylpyrazol-4-yl)-4-methyl-1,2,4-triazole Traditional Name: 3-[(2,5-dimethylbenzyl)thio]-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole Formula: C17H21N5OS MolecularWeight: 343.44654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C)C3=CN(N=C3OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C)C3=CN(N=C3OC)C

InChI

InChI=1S/C17H21N5OS/c1-11-6-7-12(2)13(8-11)10-24-17-19-18-15(22(17)4)14-9-21(3)20-16(14)23-5/h6-9H,10H2,1-5H3