(2R)-2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide

Systemtic Name: (2R)-2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide Openeye Name: (2R)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide CAS Name: (2R)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-phenylpropanamide IUPAC Name: (2R)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylpropanamide Traditional Name: (2R)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-phenyl-propionamide Formula: C15H21N5OS MolecularWeight: 319.42514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2N)C(C)(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)SC2=NN=C(N2N)C(C)(C)C

InChI

InChI=1S/C15H21N5OS/c1-10(12(21)17-11-8-6-5-7-9-11)22-14-19-18-13(20(14)16)15(2,3)4/h5-10H,16H2,1-4H3,(H,17,21)/t10-/m1/s1