4-(2-methoxyphenyl)-3-(2-methylpropylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 4-(2-methoxyphenyl)-3-(2-methylpropylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-isobutylsulfanyl-4-(2-methoxyphenyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-(2-methoxyphenyl)-3-(2-methylpropylthio)-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-(2-methoxyphenyl)-3-(2-methylpropylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-(isobutylthio)-4-(2-methoxyphenyl)-5-(2-thienyl)-1,2,4-triazole Formula: C17H19N3OS2 MolecularWeight: 345.48226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1C2=CC=CC=C2OC)C3=CC=CS3

Isomeric SMILES

CC(C)CSC1=NN=C(N1C2=CC=CC=C2OC)C3=CC=CS3

InChI

InChI=1S/C17H19N3OS2/c1-12(2)11-23-17-19-18-16(15-9-6-10-22-15)20(17)13-7-4-5-8-14(13)21-3/h4-10,12H,11H2,1-3H3