4-[2-(6-phenylsulfanylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinoline

Systemtic Name: 4-[2-(6-phenylsulfanylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinoline Openeye Name: 4-[2-(6-phenylsulfanyl-2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinoline CAS Name: 4-[2-[6-(phenylthio)-2-pyridinyl]-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinoline IUPAC Name: 4-[2-(6-phenylsulfanylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinoline Traditional Name: 4-[2-[6-(phenylthio)-2-pyridyl]-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinoline Formula: C26H20N4S MolecularWeight: 420.5288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NN2C1)C3=NC(=CC=C3)SC4=CC=CC=C4)C5=CC=NC6=CC=CC=C56

Isomeric SMILES

C1CC2=C(C(=NN2C1)C3=NC(=CC=C3)SC4=CC=CC=C4)C5=CC=NC6=CC=CC=C56

InChI

InChI=1S/C26H20N4S/c1-2-8-18(9-3-1)31-24-14-6-12-22(28-24)26-25(23-13-7-17-30(23)29-26)20-15-16-27-21-11-5-4-10-19(20)21/h1-6,8-12,14-16H,7,13,17H2