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

Systemtic Name: 3-[5-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[2-(4-bromophenoxy)ethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[2-(4-bromophenoxy)ethylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[2-(4-bromophenoxy)ethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[2-(4-bromophenoxy)ethylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]propionamide Formula: C16H19BrN4O2S MolecularWeight: 411.31666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCOC3=CC=C(C=C3)Br)CCC(=O)N

Isomeric SMILES

C1CC1N2C(=NN=C2SCCOC3=CC=C(C=C3)Br)CCC(=O)N

InChI

InChI=1S/C16H19BrN4O2S/c17-11-1-5-13(6-2-11)23-9-10-24-16-20-19-15(8-7-14(18)22)21(16)12-3-4-12/h1-2,5-6,12H,3-4,7-10H2,(H2,18,22)