(2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-(methylthio)butyrate Formula: C10H16N3O4S2- MolecularWeight: 306.38174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C10H17N3O4S2/c1-6-9(7(2)12-11-6)19(16,17)13-8(10(14)15)4-5-18-3/h8,13H,4-5H2,1-3H3,(H,11,12)(H,14,15)/p-1/t8-/m0/s1