5-[(6-chloranyl-1-oxidanylidene-4-phenyl-3-propanoyl-isoquinolin-2-yl)methyl]-N,N,2-trimethyl-pyrazole-3-carboxamide

Systemtic Name: 5-[(6-chloranyl-1-oxidanylidene-4-phenyl-3-propanoyl-isoquinolin-2-yl)methyl]-N,N,2-trimethyl-pyrazole-3-carboxamide Openeye Name: 5-[(6-chloro-1-oxo-4-phenyl-3-propanoyl-2-isoquinolyl)methyl]-N,N,2-trimethyl-pyrazole-3-carboxamide CAS Name: 5-[[6-chloro-1-oxo-3-(1-oxopropyl)-4-phenyl-2-isoquinolinyl]methyl]-N,N,2-trimethyl-3-pyrazolecarboxamide IUPAC Name: 5-[(6-chloro-1-oxo-4-phenyl-3-propanoylisoquinolin-2-yl)methyl]-N,N,2-trimethylpyrazole-3-carboxamide Traditional Name: 5-[(6-chloro-1-keto-4-phenyl-3-propionyl-2-isoquinolyl)methyl]-N,N,2-trimethyl-pyrazole-3-carboxamide Formula: C26H25ClN4O3 MolecularWeight: 476.9547

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1CC3=NN(C(=C3)C(=O)N(C)C)C)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1CC3=NN(C(=C3)C(=O)N(C)C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H25ClN4O3/c1-5-22(32)24-23(16-9-7-6-8-10-16)20-13-17(27)11-12-19(20)25(33)31(24)15-18-14-21(30(4)28-18)26(34)29(2)3/h6-14H,5,15H2,1-4H3