N-[6-[(2-morpholin-4-yl-5-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide

Systemtic Name: N-[6-[(2-morpholin-4-yl-5-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(2-morpholino-5-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[[2-(4-morpholinyl)-5-nitrophenyl]-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(2-morpholin-4-yl-5-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(2-morpholino-5-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C23H19N5O6S MolecularWeight: 493.49186

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC4=C(C=C3)N=C(S4)NC(=O)C5=CC=CO5

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC4=C(C=C3)N=C(S4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C23H19N5O6S/c29-21(16-13-15(28(31)32)4-6-18(16)27-7-10-33-11-8-27)24-14-3-5-17-20(12-14)35-23(25-17)26-22(30)19-2-1-9-34-19/h1-6,9,12-13H,7-8,10-11H2,(H,24,29)(H,25,26,30)