N-(2-methylsulfanylphenyl)-4-morpholin-4-yl-3-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

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