3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole CAS Name: 3-(3-methoxy-1-methyl-4-pyrazolyl)-4-methyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(3-methoxy-1-methylpyrazol-4-yl)-4-methyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole Formula: C15H17N5OS MolecularWeight: 315.39338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)OC)C2=NN=C(N2C)SCC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C(=N1)OC)C2=NN=C(N2C)SCC3=CC=CC=C3

InChI

InChI=1S/C15H17N5OS/c1-19-9-12(14(18-19)21-3)13-16-17-15(20(13)2)22-10-11-7-5-4-6-8-11/h4-9H,10H2,1-3H3