3-(7-methoxy-1-benzofuran-2-yl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(7-methoxy-1-benzofuran-2-yl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(7-methoxybenzofuran-2-yl)-4-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(7-methoxy-2-benzofuranyl)-4-methyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(7-methoxy-1-benzofuran-2-yl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(7-methoxybenzofuran-2-yl)-4-methyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC4=C(O3)C(=CC=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC4=C(O3)C(=CC=C4)OC

InChI

InChI=1S/C20H19N3O2S/c1-13-7-9-14(10-8-13)12-26-20-22-21-19(23(20)2)17-11-15-5-4-6-16(24-3)18(15)25-17/h4-11H,12H2,1-3H3