1-[6-[2-(2-tert-butyl-5-methyl-pyrazol-3-yl)-2-oxidanylidene-1-pyrrolidin-3-yl-ethoxy]pyridin-2-yl]-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)urea

Systemtic Name: 1-[6-[2-(2-tert-butyl-5-methyl-pyrazol-3-yl)-2-oxidanylidene-1-pyrrolidin-3-yl-ethoxy]pyridin-2-yl]-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)urea Openeye Name: 1-[6-[2-(2-tert-butyl-5-methyl-pyrazol-3-yl)-2-oxo-1-pyrrolidin-3-yl-ethoxy]-2-pyridyl]-3-[2-(4-pyridyl)thiazol-4-yl]urea CAS Name: 1-[6-[2-(2-tert-butyl-5-methyl-3-pyrazolyl)-2-oxo-1-(3-pyrrolidinyl)ethoxy]-2-pyridinyl]-3-(2-pyridin-4-yl-4-thiazolyl)urea IUPAC Name: 1-[6-[2-(2-tert-butyl-5-methylpyrazol-3-yl)-2-oxo-1-pyrrolidin-3-ylethoxy]pyridin-2-yl]-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)urea Traditional Name: 1-[6-[2-(2-tert-butyl-5-methyl-pyrazol-3-yl)-2-keto-1-pyrrolidin-3-yl-ethoxy]-2-pyridyl]-3-[2-(4-pyridyl)thiazol-4-yl]urea Formula: C28H32N8O3S MolecularWeight: 560.67048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)C(C2CCNC2)OC3=CC=CC(=N3)NC(=O)NC4=CSC(=N4)C5=CC=NC=C5)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)C(C2CCNC2)OC3=CC=CC(=N3)NC(=O)NC4=CSC(=N4)C5=CC=NC=C5)C(C)(C)C

InChI

InChI=1S/C28H32N8O3S/c1-17-14-20(36(35-17)28(2,3)4)24(37)25(19-10-13-30-15-19)39-23-7-5-6-21(31-23)33-27(38)34-22-16-40-26(32-22)18-8-11-29-12-9-18/h5-9,11-12,14,16,19,25,30H,10,13,15H2,1-4H3,(H2,31,33,34,38)