3-(3,3-dimethyl-2-pyridin-4-yl-indol-5-yl)-4,4-dimethyl-1H-pyrazol-5-one

Systemtic Name: 3-(3,3-dimethyl-2-pyridin-4-yl-indol-5-yl)-4,4-dimethyl-1H-pyrazol-5-one Openeye Name: 3-[3,3-dimethyl-2-(4-pyridyl)indol-5-yl]-4,4-dimethyl-1H-pyrazol-5-one CAS Name: 3-(3,3-dimethyl-2-pyridin-4-yl-5-indolyl)-4,4-dimethyl-1H-pyrazol-5-one IUPAC Name: 3-(3,3-dimethyl-2-pyridin-4-ylindol-5-yl)-4,4-dimethyl-1H-pyrazol-5-one Traditional Name: 5-[3,3-dimethyl-2-(4-pyridyl)indol-5-yl]-4,4-dimethyl-2-pyrazolin-3-one Formula: C20H20N4O MolecularWeight: 332.399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=NNC(=O)C3(C)C)N=C1C4=CC=NC=C4)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=NNC(=O)C3(C)C)N=C1C4=CC=NC=C4)C

InChI

InChI=1S/C20H20N4O/c1-19(2)14-11-13(17-20(3,4)18(25)24-23-17)5-6-15(14)22-16(19)12-7-9-21-10-8-12/h5-11H,1-4H3,(H,24,25)