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

Systemtic Name: 3-(furan-2-yl)-4-(4-methylphenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2-furyl)-5-(m-tolylmethylsulfanyl)-4-(p-tolyl)-1,2,4-triazole CAS Name: 3-(2-furanyl)-4-(4-methylphenyl)-5-[(3-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-4-(4-methylphenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2-furyl)-5-[(3-methylbenzyl)thio]-4-(p-tolyl)-1,2,4-triazole Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC(=C3)C)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC(=C3)C)C4=CC=CO4

InChI

InChI=1S/C21H19N3OS/c1-15-8-10-18(11-9-15)24-20(19-7-4-12-25-19)22-23-21(24)26-14-17-6-3-5-16(2)13-17/h3-13H,14H2,1-2H3