methyl (2S)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridinyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[6-(3,5-dimethylpyrazol-1-yl)nicotinoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C21H22N4O3/c1-14-11-15(2)25(24-14)19-10-9-17(13-22-19)20(26)23-18(21(27)28-3)12-16-7-5-4-6-8-16/h4-11,13,18H,12H2,1-3H3,(H,23,26)/t18-/m0/s1