N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]-3-nitro-benzamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]-3-nitro-benzamide Openeye Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]-3-nitro-benzamide CAS Name: N-[4-[[[[(5-chloro-2,4-dimethoxyphenyl)thio]amino]-oxomethyl]amino]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)sulfanylcarbamoylamino]phenyl]-3-nitrobenzamide Traditional Name: N-[4-[[(5-chloro-2,4-dimethoxy-phenyl)thio]carbamoylamino]phenyl]-3-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(11-17(18)23)34-26-22(29)25-15-8-6-14(7-9-15)24-21(28)13-4-3-5-16(10-13)27(30)31/h3-12H,1-2H3,(H,24,28)(H2,25,26,29)