S-[4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butyl] ethanethioate

Systemtic Name: S-[4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butyl] ethanethioate Openeye Name: S-[4-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]butyl] ethanethioate CAS Name: ethanethioic acid S-[4-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]butyl] ester IUPAC Name: S-[4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butyl] ethanethioate Traditional Name: ethanethioic acid S-[4-(naphthionylamino)butyl] ester Formula: C18H24N2O3S2 MolecularWeight: 380.52476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O3S2/c1-14(21)24-13-5-4-12-19-25(22,23)18-11-7-8-15-16(18)9-6-10-17(15)20(2)3/h6-11,19H,4-5,12-13H2,1-3H3