N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-2-morpholino-5-nitro-benzamide Formula: C23H20N4O5S MolecularWeight: 464.4937

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H20N4O5S/c28-22(17-13-15(27(29)30)5-7-19(17)26-9-11-31-12-10-26)24-14-16-6-8-20(32-16)23-25-18-3-1-2-4-21(18)33-23/h1-8,13H,9-12,14H2,(H,24,28)