N-[4-(diethylsulfamoyl)phenyl]-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[4-(diethylsulfamoyl)phenyl]-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-benzoyl-N-[4-(diethylsulfamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-benzoyl-N-[4-(diethylsulfamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-benzoyl-N-[4-(diethylsulfamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-benzoyl-N-[4-(diethylsulfamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4S/c1-3-29(4-2)35(33,34)24-16-14-23(15-17-24)28-26(31)25-18-21-12-8-9-13-22(21)19-30(25)27(32)20-10-6-5-7-11-20/h5-17,25H,3-4,18-19H2,1-2H3,(H,28,31)