2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylethanoylamino]ethanamide

Systemtic Name: 2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylethanoylamino]ethanamide Openeye Name: 2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylacetyl]amino]acetamide CAS Name: 2-[[2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: 2-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanylacetyl]amino]acetamide Traditional Name: 2-[[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]acetyl]amino]acetamide Formula: C15H18N4O2S MolecularWeight: 318.39402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)NCC(=O)N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)NCC(=O)N

InChI

InChI=1S/C15H18N4O2S/c1-10-15(22-9-14(21)17-8-13(16)20)11(2)19(18-10)12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H2,16,20)(H,17,21)