4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-4-(4-chlorophenyl)-5-(3-methoxyphenyl)-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-4-(4-chlorophenyl)-5-(3-methoxyphenyl)-1,2,4-triazole Formula: C18H16ClN3OS MolecularWeight: 357.85714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC=C

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC=C

InChI

InChI=1S/C18H16ClN3OS/c1-3-11-24-18-21-20-17(13-5-4-6-16(12-13)23-2)22(18)15-9-7-14(19)8-10-15/h3-10,12H,1,11H2,2H3