3-(2-methoxyphenyl)-5-(phenylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-(2-methoxyphenyl)-5-(phenylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-benzylsulfanyl-5-(2-methoxyphenyl)-1,2,4-triazole CAS Name: 3-(2-methoxyphenyl)-5-(phenylmethylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(benzylthio)-5-(2-methoxyphenyl)-1,2,4-triazole Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2CC=C)SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2CC=C)SCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3OS/c1-3-13-22-18(16-11-7-8-12-17(16)23-2)20-21-19(22)24-14-15-9-5-4-6-10-15/h3-12H,1,13-14H2,2H3