ethyl 4-[2-[2-[(3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfonylethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[2-[(3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfonylethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[2-[(3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxo-ethyl]sulfonylacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[2-[(3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfonyl-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-[(3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfonylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[2-[(3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-keto-ethyl]sulfonylacetyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H26N4O6S2 MolecularWeight: 482.57364

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCN1C2=CC=CC=C2SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C20H26N4O6S2/c1-3-24-15-7-5-6-8-16(15)31-19(24)21-17(25)13-32(28,29)14-18(26)22-9-11-23(12-10-22)20(27)30-4-2/h5-8H,3-4,9-14H2,1-2H3