4-[3-tert-butyl-5-[(4-pyridin-4-yloxyphenyl)carbamoylamino]pyrazol-1-yl]-N-(2-pyrrolidin-1-ylethyl)benzamide

Systemtic Name: 4-[3-tert-butyl-5-[(4-pyridin-4-yloxyphenyl)carbamoylamino]pyrazol-1-yl]-N-(2-pyrrolidin-1-ylethyl)benzamide Openeye Name: 4-[3-tert-butyl-5-[[4-(4-pyridyloxy)phenyl]carbamoylamino]pyrazol-1-yl]-N-(2-pyrrolidin-1-ylethyl)benzamide CAS Name: 4-[3-tert-butyl-5-[[oxo-(4-pyridin-4-yloxyanilino)methyl]amino]-1-pyrazolyl]-N-[2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 4-[3-tert-butyl-5-[(4-pyridin-4-yloxyphenyl)carbamoylamino]pyrazol-1-yl]-N-(2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 4-[3-tert-butyl-5-[[4-(4-pyridyloxy)phenyl]carbamoylamino]pyrazol-1-yl]-N-(2-pyrrolidinoethyl)benzamide Formula: C32H37N7O3 MolecularWeight: 567.68128

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=CC=NC=C3)C4=CC=C(C=C4)C(=O)NCCN5CCCC5

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)OC3=CC=NC=C3)C4=CC=C(C=C4)C(=O)NCCN5CCCC5

InChI

InChI=1S/C32H37N7O3/c1-32(2,3)28-22-29(36-31(41)35-24-8-12-26(13-9-24)42-27-14-16-33-17-15-27)39(37-28)25-10-6-23(7-11-25)30(40)34-18-21-38-19-4-5-20-38/h6-17,22H,4-5,18-21H2,1-3H3,(H,34,40)(H2,35,36,41)