4-[2-[(3,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-methoxyphenyl)-3-nitro-benzamide

Systemtic Name: 4-[2-[(3,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-methoxyphenyl)-3-nitro-benzamide Openeye Name: 4-[2-[(3,4-dichlorophenyl)methylamino]-2-oxo-ethyl]sulfanyl-N-(2-methoxyphenyl)-3-nitro-benzamide CAS Name: 4-[[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]thio]-N-(2-methoxyphenyl)-3-nitrobenzamide IUPAC Name: 4-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]sulfanyl-N-(2-methoxyphenyl)-3-nitrobenzamide Traditional Name: 4-[[2-[(3,4-dichlorobenzyl)amino]-2-keto-ethyl]thio]-N-(2-methoxyphenyl)-3-nitro-benzamide Formula: C23H19Cl2N3O5S MolecularWeight: 520.38506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SCC(=O)NCC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SCC(=O)NCC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H19Cl2N3O5S/c1-33-20-5-3-2-4-18(20)27-23(30)15-7-9-21(19(11-15)28(31)32)34-13-22(29)26-12-14-6-8-16(24)17(25)10-14/h2-11H,12-13H2,1H3,(H,26,29)(H,27,30)