1-[5-tert-butyl-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]pyrazol-3-yl]-3-(4-pyridin-3-yloxyphenyl)urea

Systemtic Name: 1-[5-tert-butyl-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]pyrazol-3-yl]-3-(4-pyridin-3-yloxyphenyl)urea Openeye Name: 1-[5-tert-butyl-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]pyrazol-3-yl]-3-[4-(3-pyridyloxy)phenyl]urea CAS Name: 1-[5-tert-butyl-2-[3-[2-(1-pyrrolidinyl)ethoxy]phenyl]-3-pyrazolyl]-3-[4-(3-pyridinyloxy)phenyl]urea IUPAC Name: 1-[5-tert-butyl-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]pyrazol-3-yl]-3-(4-pyridin-3-yloxyphenyl)urea Traditional Name: 1-[5-tert-butyl-2-[3-(2-pyrrolidinoethoxy)phenyl]pyrazol-3-yl]-3-[4-(3-pyridyloxy)phenyl]urea Formula: C31H36N6O3 MolecularWeight: 540.65594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)OC3=CN=CC=C3)C4=CC(=CC=C4)OCCN5CCCC5

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)OC3=CN=CC=C3)C4=CC(=CC=C4)OCCN5CCCC5

InChI

InChI=1S/C31H36N6O3/c1-31(2,3)28-21-29(34-30(38)33-23-11-13-25(14-12-23)40-27-10-7-15-32-22-27)37(35-28)24-8-6-9-26(20-24)39-19-18-36-16-4-5-17-36/h6-15,20-22H,4-5,16-19H2,1-3H3,(H2,33,34,38)