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

Systemtic Name: (2R)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfanylphenyl)propanamide Openeye Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfanylphenyl)propanamide CAS Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-[2-(methylthio)phenyl]propanamide IUPAC Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfanylphenyl)propanamide Traditional Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-[2-(methylthio)phenyl]propionamide Formula: C12H15N5OS2 MolecularWeight: 309.4104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC)SC2=NNC(=N2)N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1SC)SC2=NNC(=N2)N

InChI

InChI=1S/C12H15N5OS2/c1-7(20-12-15-11(13)16-17-12)10(18)14-8-5-3-4-6-9(8)19-2/h3-7H,1-2H3,(H,14,18)(H3,13,15,16,17)/t7-/m1/s1