propan-2-yl 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-(naphthionylamino)butyric acid isopropyl ester Formula: C20H28N2O4S2 MolecularWeight: 424.57732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

InChI

InChI=1S/C20H28N2O4S2/c1-14(2)26-20(23)17(12-13-27-5)21-28(24,25)19-11-7-8-15-16(19)9-6-10-18(15)22(3)4/h6-11,14,17,21H,12-13H2,1-5H3