N-[(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide

Systemtic Name: N-[(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide Openeye Name: N-[(1S)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-methyl-2-oxo-ethyl]-3,5-dimethyl-isoxazole-4-sulfonamide CAS Name: N-[(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-3,5-dimethyl-4-isoxazolesulfonamide IUPAC Name: N-[(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide Traditional Name: N-[(1S)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-1-methyl-ethyl]-3,5-dimethyl-isoxazole-4-sulfonamide Formula: C19H25N3O6S MolecularWeight: 423.4833

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NC(C)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N[C@@H](C)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C19H25N3O6S/c1-11-18(13(3)28-20-11)29(24,25)21-12(2)19(23)22-7-6-14-8-16(26-4)17(27-5)9-15(14)10-22/h8-9,12,21H,6-7,10H2,1-5H3/t12-/m0/s1