3,5-dimethoxy-N-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 3,5-dimethoxy-N-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 3,5-dimethoxy-N-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxo-propyl]benzamide CAS Name: 3,5-dimethoxy-N-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]benzamide IUPAC Name: 3,5-dimethoxy-N-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]benzamide Traditional Name: N-[3-keto-3-[(6-mesyl-1,3-benzothiazol-2-yl)amino]propyl]-3,5-dimethoxy-benzamide Formula: C20H21N3O6S2 MolecularWeight: 463.52724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C20H21N3O6S2/c1-28-13-8-12(9-14(10-13)29-2)19(25)21-7-6-18(24)23-20-22-16-5-4-15(31(3,26)27)11-17(16)30-20/h4-5,8-11H,6-7H2,1-3H3,(H,21,25)(H,22,23,24)