3-(4-methoxyphenyl)-5-(phenylmethylsulfanyl)-4-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-(4-methoxyphenyl)-5-(phenylmethylsulfanyl)-4-propan-2-yl-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-5-(phenylmethylthio)-4-propan-2-yl-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazole Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SCC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)N1C(=NN=C1SCC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H21N3OS/c1-14(2)22-18(16-9-11-17(23-3)12-10-16)20-21-19(22)24-13-15-7-5-4-6-8-15/h4-12,14H,13H2,1-3H3