dimethyl 3-[4-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbonylamino]pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbonylamino]pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-[[2-(4-pyridyl)thiazole-4-carbonyl]amino]pyrazol-1-yl]pentanedioate CAS Name: 3-[4-[[oxo-(2-pyridin-4-yl-4-thiazolyl)methyl]amino]-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-[(2-pyridin-4-yl-1,3-thiazole-4-carbonyl)amino]pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-[[2-(4-pyridyl)thiazole-4-carbonyl]amino]pyrazol-1-yl]glutaric acid dimethyl ester Formula: C19H19N5O5S MolecularWeight: 429.44966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)OC)N1C=C(C=N1)NC(=O)C2=CSC(=N2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)CC(CC(=O)OC)N1C=C(C=N1)NC(=O)C2=CSC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C19H19N5O5S/c1-28-16(25)7-14(8-17(26)29-2)24-10-13(9-21-24)22-18(27)15-11-30-19(23-15)12-3-5-20-6-4-12/h3-6,9-11,14H,7-8H2,1-2H3,(H,22,27)