3,4-dihydro-1H-isoquinolin-2-yl-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(2,4-dimethylphenyl)-5-phenylpyrazol-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]methanone Formula: C27H25N3O MolecularWeight: 407.5069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)C(=O)N4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)C(=O)N4CCC5=CC=CC=C5C4)C

InChI

InChI=1S/C27H25N3O/c1-19-12-13-25(20(2)16-19)30-26(17-24(28-30)22-9-4-3-5-10-22)27(31)29-15-14-21-8-6-7-11-23(21)18-29/h3-13,16-17H,14-15,18H2,1-2H3