1,3-bis[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]urea

Systemtic Name: 1,3-bis[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]urea Openeye Name: 1,3-bis[4-[2-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-7-quinolyl]urea CAS Name: 1,3-bis[4-[2-(2-pyridinyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-7-quinolinyl]urea IUPAC Name: 1,3-bis[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]urea Traditional Name: 1,3-bis[4-[2-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-7-quinolyl]urea Formula: C41H32N10O MolecularWeight: 680.75918

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NN2C1)C3=CC=CC=N3)C4=C5C=CC(=CC5=NC=C4)NC(=O)NC6=CC7=NC=CC(=C7C=C6)C8=C9CCCN9N=C8C1=CC=CC=N1

Isomeric SMILES

C1CC2=C(C(=NN2C1)C3=CC=CC=N3)C4=C5C=CC(=CC5=NC=C4)NC(=O)NC6=CC7=NC=CC(=C7C=C6)C8=C9CCCN9N=C8C1=CC=CC=N1

InChI

InChI=1S/C41H32N10O/c52-41(46-25-11-13-27-29(15-19-44-33(27)23-25)37-35-9-5-21-50(35)48-39(37)31-7-1-3-17-42-31)47-26-12-14-28-30(16-20-45-34(28)24-26)38-36-10-6-22-51(36)49-40(38)32-8-2-4-18-43-32/h1-4,7-8,11-20,23-24H,5-6,9-10,21-22H2,(H2,46,47,52)