N,N-diethylethanamine; 2-sulfanylbenzenesulfonamide

Systemtic Name: N,N-diethylethanamine; 2-sulfanylbenzenesulfonamide Openeye Name: N,N-diethylethanamine; 2-sulfanylbenzenesulfonamide CAS Name: N,N-diethylethanamine; 2-mercaptobenzenesulfonamide IUPAC Name: N,N-diethylethanamine; 2-sulfanylbenzenesulfonamide Traditional Name: 2-mercaptobenzenesulfonamide; triethylamine Formula: C12H22N2O2S2 MolecularWeight: 290.44528

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1=CC=C(C(=C1)S)S(=O)(=O)N

Isomeric SMILES

CCN(CC)CC.C1=CC=C(C(=C1)S)S(=O)(=O)N

InChI

InChI=1S/C6H7NO2S2.C6H15N/c7-11(8,9)6-4-2-1-3-5(6)10;1-4-7(5-2)6-3/h1-4,10H,(H2,7,8,9);4-6H2,1-3H3