3-(4-bromophenyl)-4-(3-chloranyl-4-methoxy-phenyl)-5-(2-methoxyethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(4-bromophenyl)-4-(3-chloranyl-4-methoxy-phenyl)-5-(2-methoxyethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(4-bromophenyl)-4-(3-chloro-4-methoxy-phenyl)-5-(2-methoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-(4-bromophenyl)-4-(3-chloro-4-methoxyphenyl)-5-(2-methoxyethylthio)-1,2,4-triazole IUPAC Name: 3-(4-bromophenyl)-4-(3-chloro-4-methoxyphenyl)-5-(2-methoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(4-bromophenyl)-4-(3-chloro-4-methoxy-phenyl)-5-(2-methoxyethylthio)-1,2,4-triazole Formula: C18H17BrClN3O2S MolecularWeight: 454.76848

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Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=NN=C(N1C2=CC(=C(C=C2)OC)Cl)C3=CC=C(C=C3)Br

Isomeric SMILES

COCCSC1=NN=C(N1C2=CC(=C(C=C2)OC)Cl)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrClN3O2S/c1-24-9-10-26-18-22-21-17(12-3-5-13(19)6-4-12)23(18)14-7-8-16(25-2)15(20)11-14/h3-8,11H,9-10H2,1-2H3