4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-N-methyl-benzenesulfonamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-N-methyl-benzenesulfonamide Openeye Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-N-methyl-benzenesulfonamide CAS Name: 4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-N-methylbenzenesulfonamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N-methylbenzenesulfonamide Traditional Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-N-methyl-benzenesulfonamide Formula: C28H28N4O4S MolecularWeight: 516.61132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H28N4O4S/c1-20-26(28(34)32(29(20)2)24-11-5-4-6-12-24)30(3)37(35,36)25-15-13-22(14-16-25)27(33)31-18-17-21-9-7-8-10-23(21)19-31/h4-16H,17-19H2,1-3H3