4-(2-methoxyethylamino)-N-(2-methylsulfanylphenyl)-3-nitro-benzamide

Systemtic Name: 4-(2-methoxyethylamino)-N-(2-methylsulfanylphenyl)-3-nitro-benzamide Openeye Name: 4-(2-methoxyethylamino)-N-(2-methylsulfanylphenyl)-3-nitro-benzamide CAS Name: 4-(2-methoxyethylamino)-N-[2-(methylthio)phenyl]-3-nitrobenzamide IUPAC Name: 4-(2-methoxyethylamino)-N-(2-methylsulfanylphenyl)-3-nitrobenzamide Traditional Name: 4-(2-methoxyethylamino)-N-[2-(methylthio)phenyl]-3-nitro-benzamide Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SC)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SC)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O4S/c1-24-10-9-18-13-8-7-12(11-15(13)20(22)23)17(21)19-14-5-3-4-6-16(14)25-2/h3-8,11,18H,9-10H2,1-2H3,(H,19,21)