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

Systemtic Name: N-(6-morpholin-4-yl-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-(6-morpholino-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[6-(4-morpholinyl)-1,3-benzothiazol-2-yl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-(6-morpholin-4-yl-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-(6-morpholino-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)-2-furamide Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O5S/c27-21(19-7-6-18(31-19)14-2-1-3-16(12-14)26(28)29)24-22-23-17-5-4-15(13-20(17)32-22)25-8-10-30-11-9-25/h1-7,12-13H,8-11H2,(H,23,24,27)