3-[(4-methoxyphenyl)methyl]-4-(phenylmethyl)-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-4-(phenylmethyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-4-benzyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole CAS Name: 3-[(4-methoxyphenyl)methyl]-4-(phenylmethyl)-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 4-benzyl-3-[(4-methoxyphenyl)methyl]-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-4-benzyl-5-p-anisyl-1,2,4-triazole Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(N2CC3=CC=CC=C3)SCC=C

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(N2CC3=CC=CC=C3)SCC=C

InChI

InChI=1S/C20H21N3OS/c1-3-13-25-20-22-21-19(14-16-9-11-18(24-2)12-10-16)23(20)15-17-7-5-4-6-8-17/h3-12H,1,13-15H2,2H3