4-[5-(2-chloranylprop-2-enylsulfanyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-(2-chloranylprop-2-enylsulfanyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-(2-chloroallylsulfanyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-(2-chloroprop-2-enylthio)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-(2-chloroprop-2-enylsulfanyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-(2-chloroallylthio)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine Formula: C17H15ClN4OS MolecularWeight: 358.8452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=C)Cl)C3=CC=NC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=C)Cl)C3=CC=NC=C3

InChI

InChI=1S/C17H15ClN4OS/c1-12(18)11-24-17-21-20-16(13-7-9-19-10-8-13)22(17)14-3-5-15(23-2)6-4-14/h3-10H,1,11H2,2H3