N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]-2-nitro-benzamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]-2-nitro-benzamide Openeye Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]-2-nitro-benzamide CAS Name: N-[4-[[[[(5-chloro-2,4-dimethoxyphenyl)thio]amino]-oxomethyl]amino]phenyl]-2-nitrobenzamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)sulfanylcarbamoylamino]phenyl]-2-nitrobenzamide Traditional Name: N-[4-[[(5-chloro-2,4-dimethoxy-phenyl)thio]carbamoylamino]phenyl]-2-nitro-benzamide Formula: C22H19ClN4O6S MolecularWeight: 502.92746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1SNC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1SNC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C22H19ClN4O6S/c1-32-18-12-19(33-2)20(11-16(18)23)34-26-22(29)25-14-9-7-13(8-10-14)24-21(28)15-5-3-4-6-17(15)27(30)31/h3-12H,1-2H3,(H,24,28)(H2,25,26,29)