3-(2-chloroethylsulfanyl)-4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazole

Systemtic Name: 3-(2-chloroethylsulfanyl)-4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazole Openeye Name: 3-(2-chloroethylsulfanyl)-4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazole CAS Name: 3-(2-chloroethylthio)-4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazole IUPAC Name: 3-(2-chloroethylsulfanyl)-4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-(2-chloroethylthio)-4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazole Formula: C17H16ClN3OS MolecularWeight: 345.84644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCCCl)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCCCl)C3=CC=CC=C3

InChI

InChI=1S/C17H16ClN3OS/c1-22-15-9-7-14(8-10-15)21-16(13-5-3-2-4-6-13)19-20-17(21)23-12-11-18/h2-10H,11-12H2,1H3