N-(5-chloranyl-1,3-benzothiazol-2-yl)-N-ethyl-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-(5-chloranyl-1,3-benzothiazol-2-yl)-N-ethyl-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(5-chloro-1,3-benzothiazol-2-yl)-N-ethyl-2-morpholino-5-nitro-benzamide CAS Name: N-(5-chloro-1,3-benzothiazol-2-yl)-N-ethyl-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(5-chloro-1,3-benzothiazol-2-yl)-N-ethyl-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(5-chloro-1,3-benzothiazol-2-yl)-N-ethyl-2-morpholino-5-nitro-benzamide Formula: C20H19ClN4O4S MolecularWeight: 446.90726

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=C(S1)C=CC(=C2)Cl)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

CCN(C1=NC2=C(S1)C=CC(=C2)Cl)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C20H19ClN4O4S/c1-2-24(20-22-16-11-13(21)3-6-18(16)30-20)19(26)15-12-14(25(27)28)4-5-17(15)23-7-9-29-10-8-23/h3-6,11-12H,2,7-10H2,1H3