2-[2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoylamino]-4,5-dimethoxy-N-methyl-benzamide

Systemtic Name: 2-[2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoylamino]-4,5-dimethoxy-N-methyl-benzamide Openeye Name: 2-[[2-(4-carbamoyl-2-nitro-phenyl)sulfanylacetyl]amino]-4,5-dimethoxy-N-methyl-benzamide CAS Name: 2-[[2-[(4-carbamoyl-2-nitrophenyl)thio]-1-oxoethyl]amino]-4,5-dimethoxy-N-methylbenzamide IUPAC Name: 2-[[2-(4-carbamoyl-2-nitrophenyl)sulfanylacetyl]amino]-4,5-dimethoxy-N-methylbenzamide Traditional Name: 2-[[2-[(4-carbamoyl-2-nitro-phenyl)thio]acetyl]amino]-4,5-dimethoxy-N-methyl-benzamide Formula: C19H20N4O7S MolecularWeight: 448.4497

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=C(C=C1NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC)OC

Isomeric SMILES

CNC(=O)C1=CC(=C(C=C1NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C19H20N4O7S/c1-21-19(26)11-7-14(29-2)15(30-3)8-12(11)22-17(24)9-31-16-5-4-10(18(20)25)6-13(16)23(27)28/h4-8H,9H2,1-3H3,(H2,20,25)(H,21,26)(H,22,24)