3-[[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]sulfonylamino]-N-(3,4-dimethoxyphenyl)propanamide

Systemtic Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]sulfonylamino]-N-(3,4-dimethoxyphenyl)propanamide Openeye Name: 3-[[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]sulfonylamino]-N-(3,4-dimethoxyphenyl)propanamide CAS Name: 3-[[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]sulfonylamino]-N-(3,4-dimethoxyphenyl)propanamide IUPAC Name: 3-[[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]sulfonylamino]-N-(3,4-dimethoxyphenyl)propanamide Traditional Name: 3-[[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]sulfonylamino]-N-(3,4-dimethoxyphenyl)propionamide Formula: C27H29N3O6S MolecularWeight: 523.60066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC=CC=C2C(=O)N3CCC4=CC=CC=C4C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC=CC=C2C(=O)N3CCC4=CC=CC=C4C3)OC

InChI

InChI=1S/C27H29N3O6S/c1-35-23-12-11-21(17-24(23)36-2)29-26(31)13-15-28-37(33,34)25-10-6-5-9-22(25)27(32)30-16-14-19-7-3-4-8-20(19)18-30/h3-12,17,28H,13-16,18H2,1-2H3,(H,29,31)