3-cyano-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5,5-dimethyl-2,6-bis(oxidanylidene)hexanamide

Systemtic Name: 3-cyano-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5,5-dimethyl-2,6-bis(oxidanylidene)hexanamide Openeye Name: 3-cyano-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5,5-dimethyl-2,6-dioxo-hexanamide CAS Name: 3-cyano-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5,5-dimethyl-2,6-dioxohexanamide IUPAC Name: 3-cyano-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5,5-dimethyl-2,6-dioxohexanamide Traditional Name: 3-cyano-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,6-diketo-5,5-dimethyl-hexanamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)C(CC(C)(C)C=O)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)C(CC(C)(C)C=O)C#N

InChI

InChI=1S/C18H19N3O4S/c1-4-25-12-5-6-13-14(7-12)26-17(20-13)21-16(24)15(23)11(9-19)8-18(2,3)10-22/h5-7,10-11H,4,8H2,1-3H3,(H,20,21,24)