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

Systemtic Name: (2R)-2-[[4-azanyl-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide Openeye Name: (2R)-2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide CAS Name: (2R)-2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclopentylpropanamide IUPAC Name: (2R)-2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylpropanamide Traditional Name: (2R)-2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclopentyl-propionamide Formula: C16H20BrN5OS MolecularWeight: 410.3319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NN=C(N2N)C3=CC(=CC=C3)Br

Isomeric SMILES

C[C@H](C(=O)NC1CCCC1)SC2=NN=C(N2N)C3=CC(=CC=C3)Br

InChI

InChI=1S/C16H20BrN5OS/c1-10(15(23)19-13-7-2-3-8-13)24-16-21-20-14(22(16)18)11-5-4-6-12(17)9-11/h4-6,9-10,13H,2-3,7-8,18H2,1H3,(H,19,23)/t10-/m1/s1