2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-N-[(2-morpholin-4-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-N-[(2-morpholin-4-ylphenyl)methyl]ethanamide Openeye Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-N-[(2-morpholinophenyl)methyl]acetamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylthio]-N-methyl-N-[[2-(4-morpholinyl)phenyl]methyl]acetamide IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-N-methyl-N-[(2-morpholin-4-ylphenyl)methyl]acetamide Traditional Name: 2-[(4-methoxy-3-nitro-benzyl)thio]-N-methyl-N-(2-morpholinobenzyl)acetamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCOCC2)C(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCOCC2)C(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O5S/c1-23(14-18-5-3-4-6-19(18)24-9-11-30-12-10-24)22(26)16-31-15-17-7-8-21(29-2)20(13-17)25(27)28/h3-8,13H,9-12,14-16H2,1-2H3