N-[1-(3,5-dimethylpyrazol-1-yl)propan-2-yl]-2-[4-(2-phenylsulfanylethanoylamino)pyrazol-1-yl]ethanamide

Systemtic Name: N-[1-(3,5-dimethylpyrazol-1-yl)propan-2-yl]-2-[4-(2-phenylsulfanylethanoylamino)pyrazol-1-yl]ethanamide Openeye Name: N-[2-(3,5-dimethylpyrazol-1-yl)-1-methyl-ethyl]-2-[4-[(2-phenylsulfanylacetyl)amino]pyrazol-1-yl]acetamide CAS Name: N-[1-(3,5-dimethyl-1-pyrazolyl)propan-2-yl]-2-[4-[[1-oxo-2-(phenylthio)ethyl]amino]-1-pyrazolyl]acetamide IUPAC Name: N-[1-(3,5-dimethylpyrazol-1-yl)propan-2-yl]-2-[4-[(2-phenylsulfanylacetyl)amino]pyrazol-1-yl]acetamide Traditional Name: N-[2-(3,5-dimethylpyrazol-1-yl)-1-methyl-ethyl]-2-[4-[[2-(phenylthio)acetyl]amino]pyrazol-1-yl]acetamide Formula: C21H26N6O2S MolecularWeight: 426.53514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(C)NC(=O)CN2C=C(C=N2)NC(=O)CSC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NN1CC(C)NC(=O)CN2C=C(C=N2)NC(=O)CSC3=CC=CC=C3)C

InChI

InChI=1S/C21H26N6O2S/c1-15-9-17(3)27(25-15)11-16(2)23-20(28)13-26-12-18(10-22-26)24-21(29)14-30-19-7-5-4-6-8-19/h4-10,12,16H,11,13-14H2,1-3H3,(H,23,28)(H,24,29)