2-chloranyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-benzamide Openeye Name: 2-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-5-nitro-benzamide CAS Name: 2-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitrobenzamide Traditional Name: 2-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-5-nitro-benzamide Formula: C22H23ClN4O5S MolecularWeight: 490.95982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H23ClN4O5S/c1-2-32-16-4-6-19-20(14-16)33-22(24-19)26(8-7-25-9-11-31-12-10-25)21(28)17-13-15(27(29)30)3-5-18(17)23/h3-6,13-14H,2,7-12H2,1H3