N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-4-nitro-3-oxidanyl-benzamide Openeye Name: 3-hydroxy-N-[4-(2-morpholinothiazol-4-yl)phenyl]-4-nitro-benzamide CAS Name: 3-hydroxy-N-[4-[2-(4-morpholinyl)-4-thiazolyl]phenyl]-4-nitrobenzamide IUPAC Name: 3-hydroxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-4-nitrobenzamide Traditional Name: 3-hydroxy-N-[4-(2-morpholinothiazol-4-yl)phenyl]-4-nitro-benzamide Formula: C20H18N4O5S MolecularWeight: 426.44572

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1COCCN1C2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C20H18N4O5S/c25-18-11-14(3-6-17(18)24(27)28)19(26)21-15-4-1-13(2-5-15)16-12-30-20(22-16)23-7-9-29-10-8-23/h1-6,11-12,25H,7-10H2,(H,21,26)