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

Systemtic Name: (2R)-2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-propanamide Openeye Name: (2R)-2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-propanamide CAS Name: (2R)-2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-cyclopropylpropanamide IUPAC Name: (2R)-2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropylpropanamide Traditional Name: (2R)-2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-propionamide Formula: C15H17BrN4OS MolecularWeight: 381.29068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)SC2=NN=C(N2C)C3=CC(=CC=C3)Br

Isomeric SMILES

C[C@H](C(=O)NC1CC1)SC2=NN=C(N2C)C3=CC(=CC=C3)Br

InChI

InChI=1S/C15H17BrN4OS/c1-9(14(21)17-12-6-7-12)22-15-19-18-13(20(15)2)10-4-3-5-11(16)8-10/h3-5,8-9,12H,6-7H2,1-2H3,(H,17,21)/t9-/m1/s1