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

Systemtic Name: 4-[(3,3-diethyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(3,3-diethyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(3,3-diethyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(3,3-diethyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(3,3-diethyl-4H-isoquinolin-1-yl)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N4O/c1-5-24(6-2)16-18-12-10-11-15-20(18)22(26-24)25-21-17(3)27(4)28(23(21)29)19-13-8-7-9-14-19/h7-15H,5-6,16H2,1-4H3,(H,25,26)