[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C13H16N4OS3 MolecularWeight: 340.48734

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)NC1=CC=CC2=NSN=C21

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)NC1=CC=CC2=NSN=C21

InChI

InChI=1S/C13H16N4OS3/c1-3-17(4-2)13(19)20-8-11(18)14-9-6-5-7-10-12(9)16-21-15-10/h5-7H,3-4,8H2,1-2H3,(H,14,18)