N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-(2,5-diethoxy-4-morpholino-phenyl)-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[2,5-diethoxy-4-(4-morpholinyl)phenyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-(2,5-diethoxy-4-morpholin-4-ylphenyl)-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-(2,5-diethoxy-4-morpholino-phenyl)-2-[(4-nitrophenyl)thio]acetamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O6S/c1-3-30-20-14-19(24-9-11-29-12-10-24)21(31-4-2)13-18(20)23-22(26)15-32-17-7-5-16(6-8-17)25(27)28/h5-8,13-14H,3-4,9-12,15H2,1-2H3,(H,23,26)