S-[6-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]hexyl] ethanethioate

Systemtic Name: S-[6-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]hexyl] ethanethioate Openeye Name: S-[6-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]hexyl] ethanethioate CAS Name: ethanethioic acid S-[6-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]hexyl] ester IUPAC Name: S-[6-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]hexyl] ethanethioate Traditional Name: ethanethioic acid S-[6-(naphthionylamino)hexyl] ester Formula: C20H28N2O3S2 MolecularWeight: 408.57792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCCCNS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

Isomeric SMILES

CC(=O)SCCCCCCNS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

InChI

InChI=1S/C20H28N2O3S2/c1-16(23)26-15-7-5-4-6-14-21-27(24,25)20-13-9-10-17-18(20)11-8-12-19(17)22(2)3/h8-13,21H,4-7,14-15H2,1-3H3