N-[3-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3-nitro-benzamide

Systemtic Name: N-[3-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3-nitro-benzamide Openeye Name: N-[3-[2-(5-chloro-2,4-dimethoxy-anilino)-2-oxo-ethyl]sulfanylphenyl]-3-nitro-benzamide CAS Name: N-[3-[[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]thio]phenyl]-3-nitrobenzamide IUPAC Name: N-[3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]sulfanylphenyl]-3-nitrobenzamide Traditional Name: N-[3-[[2-(5-chloro-2,4-dimethoxy-anilino)-2-keto-ethyl]thio]phenyl]-3-nitro-benzamide Formula: C23H20ClN3O6S MolecularWeight: 501.9394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C23H20ClN3O6S/c1-32-20-12-21(33-2)19(11-18(20)24)26-22(28)13-34-17-8-4-6-15(10-17)25-23(29)14-5-3-7-16(9-14)27(30)31/h3-12H,13H2,1-2H3,(H,25,29)(H,26,28)