5-[2-(ethanethioylamino)ethylamino]naphthalene-1-sulfonic acid

Systemtic Name: 5-[2-(ethanethioylamino)ethylamino]naphthalene-1-sulfonic acid Openeye Name: 5-[2-(ethanethioylamino)ethylamino]naphthalene-1-sulfonic acid CAS Name: 5-[2-(1-sulfanylideneethylamino)ethylamino]-1-naphthalenesulfonic acid IUPAC Name: 5-[2-(ethanethioylamino)ethylamino]naphthalene-1-sulfonic acid Traditional Name: 5-[2-(thioacetylamino)ethylamino]naphthalene-1-sulfonic acid Formula: C14H16N2O3S2 MolecularWeight: 324.41844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCCNC1=CC=CC2=C1C=CC=C2S(=O)(=O)O

Isomeric SMILES

CC(=S)NCCNC1=CC=CC2=C1C=CC=C2S(=O)(=O)O

InChI

InChI=1S/C14H16N2O3S2/c1-10(20)15-8-9-16-13-6-2-5-12-11(13)4-3-7-14(12)21(17,18)19/h2-7,16H,8-9H2,1H3,(H,15,20)(H,17,18,19)