2-[4-[(6-chloranyl-4-phenyl-3-propanoyl-1H-isoquinolin-2-yl)carbonyl]phenyl]carbonylbenzenesulfonamide

Systemtic Name: 2-[4-[(6-chloranyl-4-phenyl-3-propanoyl-1H-isoquinolin-2-yl)carbonyl]phenyl]carbonylbenzenesulfonamide Openeye Name: 2-[4-(6-chloro-4-phenyl-3-propanoyl-1H-isoquinoline-2-carbonyl)benzoyl]benzenesulfonamide CAS Name: 2-[[4-[[6-chloro-3-(1-oxopropyl)-4-phenyl-1H-isoquinolin-2-yl]-oxomethyl]phenyl]-oxomethyl]benzenesulfonamide IUPAC Name: 2-[4-(6-chloro-4-phenyl-3-propanoyl-1H-isoquinoline-2-carbonyl)benzoyl]benzenesulfonamide Traditional Name: 2-[4-(6-chloro-4-phenyl-3-propionyl-1H-isoquinoline-2-carbonyl)benzoyl]benzenesulfonamide Formula: C32H25ClN2O5S MolecularWeight: 585.0693

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C2=C(CN1C(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4S(=O)(=O)N)C=CC(=C2)Cl)C5=CC=CC=C5

Isomeric SMILES

CCC(=O)C1=C(C2=C(CN1C(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4S(=O)(=O)N)C=CC(=C2)Cl)C5=CC=CC=C5

InChI

InChI=1S/C32H25ClN2O5S/c1-2-27(36)30-29(20-8-4-3-5-9-20)26-18-24(33)17-16-23(26)19-35(30)32(38)22-14-12-21(13-15-22)31(37)25-10-6-7-11-28(25)41(34,39)40/h3-18H,2,19H2,1H3,(H2,34,39,40)