N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C21H25N3O6S3 MolecularWeight: 511.6347

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC(=C(C=C2SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4)OC)OC

Isomeric SMILES

COCCN1C2=CC(=C(C=C2SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4)OC)OC

InChI

InChI=1S/C21H25N3O6S3/c1-28-10-9-23-15-12-16(29-2)17(30-3)13-18(15)32-21(23)22-20(25)14-6-4-8-24(14)33(26,27)19-7-5-11-31-19/h5,7,11-14H,4,6,8-10H2,1-3H3