3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-[(4-methylphenyl)sulfonylmethyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-[(4-methylphenyl)sulfonylmethyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-(p-tolylsulfonylmethyl)-1,2,4-triazole CAS Name: 3-[2-(4-methoxyphenoxy)ethylthio]-5-[(4-methylphenyl)sulfonylmethyl]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-[(4-methylphenyl)sulfonylmethyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[2-(4-methoxyphenoxy)ethylthio]-5-(tosylmethyl)-1,2,4-triazole Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=NN=C(N2CC=C)SCCOC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=NN=C(N2CC=C)SCCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N3O4S2/c1-4-13-25-21(16-31(26,27)20-11-5-17(2)6-12-20)23-24-22(25)30-15-14-29-19-9-7-18(28-3)8-10-19/h4-12H,1,13-16H2,2-3H3