4-methylsulfanyl-N-(2-morpholin-4-ylphenyl)-3-nitro-benzamide

Systemtic Name: 4-methylsulfanyl-N-(2-morpholin-4-ylphenyl)-3-nitro-benzamide Openeye Name: 4-methylsulfanyl-N-(2-morpholinophenyl)-3-nitro-benzamide CAS Name: 4-(methylthio)-N-[2-(4-morpholinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-methylsulfanyl-N-(2-morpholin-4-ylphenyl)-3-nitrobenzamide Traditional Name: 4-(methylthio)-N-(2-morpholinophenyl)-3-nitro-benzamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O4S/c1-26-17-7-6-13(12-16(17)21(23)24)18(22)19-14-4-2-3-5-15(14)20-8-10-25-11-9-20/h2-7,12H,8-11H2,1H3,(H,19,22)