(2R)-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-propanamide

Systemtic Name: (2R)-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-propanamide Openeye Name: (2R)-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-propanamide CAS Name: (2R)-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-cyclopropylpropanamide IUPAC Name: (2R)-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropylpropanamide Traditional Name: (2R)-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-propionamide Formula: C14H15BrN4OS MolecularWeight: 367.2641

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)SC2=NNC(=N2)C3=CC=CC=C3Br

Isomeric SMILES

C[C@H](C(=O)NC1CC1)SC2=NNC(=N2)C3=CC=CC=C3Br

InChI

InChI=1S/C14H15BrN4OS/c1-8(13(20)16-9-6-7-9)21-14-17-12(18-19-14)10-4-2-3-5-11(10)15/h2-5,8-9H,6-7H2,1H3,(H,16,20)(H,17,18,19)/t8-/m1/s1