N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-furan-2-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-furan-2-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-5-nitro-furan-2-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-5-nitro-2-furancarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitrofuran-2-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-5-nitro-2-furamide Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O6S/c1-2-29-14-3-4-15-17(13-14)31-20(21-15)23(8-7-22-9-11-28-12-10-22)19(25)16-5-6-18(30-16)24(26)27/h3-6,13H,2,7-12H2,1H3