2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H25N3O3S/c25-21(16-23-14-11-17-5-1-2-6-18(17)15-23)22-19-7-9-20(10-8-19)28(26,27)24-12-3-4-13-24/h1-2,5-10H,3-4,11-16H2,(H,22,25)