N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanamide Openeye Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide CAS Name: N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide IUPAC Name: N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Traditional Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C21H24ClN3O4S/c22-19-6-5-18(30(27,28)25-9-11-29-12-10-25)13-20(19)23-21(26)15-24-8-7-16-3-1-2-4-17(16)14-24/h1-6,13H,7-12,14-15H2,(H,23,26)