N-(2-chloranyl-4,5-dimethoxy-phenyl)-2-cyclopropyl-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-4,5-dimethoxy-phenyl)-2-cyclopropyl-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-4,5-dimethoxy-phenyl)-2-cyclopropyl-1,1,3-trioxo-1,2-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-4,5-dimethoxyphenyl)-2-cyclopropyl-1,1,3-trioxo-1,2-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-4,5-dimethoxyphenyl)-2-cyclopropyl-1,1,3-trioxo-1,2-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-4,5-dimethoxy-phenyl)-2-cyclopropyl-1,1,3-triketo-1,2-benzothiazole-6-carboxamide Formula: C19H17ClN2O6S MolecularWeight: 436.86608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(S3(=O)=O)C4CC4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(S3(=O)=O)C4CC4)Cl)OC

InChI

InChI=1S/C19H17ClN2O6S/c1-27-15-8-13(20)14(9-16(15)28-2)21-18(23)10-3-6-12-17(7-10)29(25,26)22(19(12)24)11-4-5-11/h3,6-9,11H,4-5H2,1-2H3,(H,21,23)