N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxidanylidene-ethyl]-N-propyl-isoquinoline-5-sulfonamide

Systemtic Name: N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxidanylidene-ethyl]-N-propyl-isoquinoline-5-sulfonamide Openeye Name: N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxo-ethyl]-N-propyl-isoquinoline-5-sulfonamide CAS Name: N-[2-(2,6-dimethyl-4-morpholinyl)-2-oxoethyl]-N-propyl-5-isoquinolinesulfonamide IUPAC Name: N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-N-propylisoquinoline-5-sulfonamide Traditional Name: N-[2-(2,6-dimethylmorpholino)-2-keto-ethyl]-N-propyl-isoquinoline-5-sulfonamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N1CC(OC(C1)C)C)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCN(CC(=O)N1CC(OC(C1)C)C)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C20H27N3O4S/c1-4-10-23(14-20(24)22-12-15(2)27-16(3)13-22)28(25,26)19-7-5-6-17-11-21-9-8-18(17)19/h5-9,11,15-16H,4,10,12-14H2,1-3H3