3-[5-[(3-bromophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[(3-bromophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(3-bromophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(3-bromophenyl)methylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(3-bromophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(3-bromobenzyl)thio]-4-cyclopropyl-1,2,4-triazol-3-yl]propionamide Formula: C15H17BrN4OS MolecularWeight: 381.29068

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC(=CC=C3)Br)CCC(=O)N

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC(=CC=C3)Br)CCC(=O)N

InChI

InChI=1S/C15H17BrN4OS/c16-11-3-1-2-10(8-11)9-22-15-19-18-14(7-6-13(17)21)20(15)12-4-5-12/h1-3,8,12H,4-7,9H2,(H2,17,21)