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

Systemtic Name: (2R)-2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-bromophenyl)propanamide Openeye Name: (2R)-2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-bromophenyl)propanamide CAS Name: (2R)-2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-N-(4-bromophenyl)propanamide IUPAC Name: (2R)-2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-bromophenyl)propanamide Traditional Name: (2R)-2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-N-(4-bromophenyl)propionamide Formula: C12H14BrN5OS MolecularWeight: 356.24146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SC(C)C(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=NN=C(N1N)S[C@H](C)C(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C12H14BrN5OS/c1-7(20-12-17-16-8(2)18(12)14)11(19)15-10-5-3-9(13)4-6-10/h3-7H,14H2,1-2H3,(H,15,19)/t7-/m1/s1