3-[3-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-[2-(2-bromo-4-chloro-phenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[2-(2-bromo-4-chlorophenoxy)ethylthio]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[2-(2-bromo-4-chlorophenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[2-(2-bromo-4-chloro-phenoxy)ethylthio]-5-cyclopropyl-1,2,4-triazol-4-yl]propionamide Formula: C16H18BrClN4O2S MolecularWeight: 445.76172

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2CCC(=O)N)SCCOC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1CC1C2=NN=C(N2CCC(=O)N)SCCOC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C16H18BrClN4O2S/c17-12-9-11(18)3-4-13(12)24-7-8-25-16-21-20-15(10-1-2-10)22(16)6-5-14(19)23/h3-4,9-10H,1-2,5-8H2,(H2,19,23)