[2,5-bis(methoxycarbonyl)phenyl]sulfonyl-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)azanide

Systemtic Name: [2,5-bis(methoxycarbonyl)phenyl]sulfonyl-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)azanide Openeye Name: [2,5-bis(methoxycarbonyl)phenyl]sulfonyl-(2-morpholino-1,3-benzothiazol-6-yl)azanide CAS Name: [2,5-bis(methoxycarbonyl)phenyl]sulfonyl-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]azanide IUPAC Name: [2,5-bis(methoxycarbonyl)phenyl]sulfonyl-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)azanide Traditional Name: (2,5-dicarbomethoxyphenyl)sulfonyl-(2-morpholino-1,3-benzothiazol-6-yl)azanide Formula: C21H20N3O7S2- MolecularWeight: 490.5294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)[N-]C2=CC3=C(C=C2)N=C(S3)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)[N-]C2=CC3=C(C=C2)N=C(S3)N4CCOCC4

InChI

InChI=1S/C21H20N3O7S2/c1-29-19(25)13-3-5-15(20(26)30-2)18(11-13)33(27,28)23-14-4-6-16-17(12-14)32-21(22-16)24-7-9-31-10-8-24/h3-6,11-12H,7-10H2,1-2H3/q-1