4-(4-methoxyphenyl)-3-[(2-methylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 4-(4-methoxyphenyl)-3-[(2-methylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-(4-methoxyphenyl)-3-(o-tolylmethylsulfanyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-(4-methoxyphenyl)-3-[(2-methylphenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-(4-methoxyphenyl)-3-[(2-methylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-(4-methoxyphenyl)-3-[(2-methylbenzyl)thio]-5-(2-thienyl)-1,2,4-triazole Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=CS4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=CS4

InChI

InChI=1S/C21H19N3OS2/c1-15-6-3-4-7-16(15)14-27-21-23-22-20(19-8-5-13-26-19)24(21)17-9-11-18(25-2)12-10-17/h3-13H,14H2,1-2H3