N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfonyl-ethanamide

Systemtic Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfonyl-ethanamide Openeye Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-morpholino-2-oxo-ethyl)sulfonyl-acetamide CAS Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-[2-(4-morpholinyl)-2-oxoethyl]sulfonylacetamide IUPAC Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-morpholin-4-yl-2-oxoethyl)sulfonylacetamide Traditional Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-keto-2-morpholino-ethyl)sulfonyl-acetamide Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)N3CCOCC3)S2)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)N3CCOCC3)S2)C

InChI

InChI=1S/C17H21N3O5S2/c1-12-3-4-13-14(9-12)26-17(19(13)2)18-15(21)10-27(23,24)11-16(22)20-5-7-25-8-6-20/h3-4,9H,5-8,10-11H2,1-2H3