4-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C23H26N4O MolecularWeight: 374.47874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C(=N1)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C

Isomeric SMILES

CCC1(CC2=CC=CC=C2C(=N1)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C

InChI

InChI=1S/C23H26N4O/c1-5-23(3)15-17-11-9-10-14-19(17)21(25-23)24-20-16(2)26(4)27(22(20)28)18-12-7-6-8-13-18/h6-14H,5,15H2,1-4H3,(H,24,25)