N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-4-morpholino-3-nitro-benzamide Formula: C22H20N4O6S MolecularWeight: 468.4824

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCCO5)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCCO5)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O6S/c27-21(15-1-3-17(18(11-15)26(28)29)25-5-7-30-8-6-25)24-22-23-16(13-33-22)14-2-4-19-20(12-14)32-10-9-31-19/h1-4,11-13H,5-10H2,(H,23,24,27)