3-(1-benzofuran-2-yl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(1-benzofuran-2-yl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(benzofuran-2-yl)-4-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(2-benzofuranyl)-4-methyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(1-benzofuran-2-yl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(benzofuran-2-yl)-4-methyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C19H17N3OS/c1-13-7-9-14(10-8-13)12-24-19-21-20-18(22(19)2)17-11-15-5-3-4-6-16(15)23-17/h3-11H,12H2,1-2H3