N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-(2,5-dimethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-(2,5-dimethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(2,5-dimethoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(2,5-dimethoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(2,5-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(2,5-dimethoxyphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN3O4S/c1-27-13-4-6-16(28-2)15(9-13)24-10-11(7-18(24)25)19(26)23-20-22-14-5-3-12(21)8-17(14)29-20/h3-6,8-9,11H,7,10H2,1-2H3,(H,22,23,26)