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

Systemtic Name: 4-[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-methoxyphenyl)-3-nitro-benzamide Openeye Name: 4-[2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl]sulfanyl-N-(2-methoxyphenyl)-3-nitro-benzamide CAS Name: 4-[[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]thio]-N-(2-methoxyphenyl)-3-nitrobenzamide IUPAC Name: 4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]sulfanyl-N-(2-methoxyphenyl)-3-nitrobenzamide Traditional Name: 4-[[2-[(2-chlorobenzyl)amino]-2-keto-ethyl]thio]-N-(2-methoxyphenyl)-3-nitro-benzamide Formula: C23H20ClN3O5S MolecularWeight: 485.94

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SCC(=O)NCC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SCC(=O)NCC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H20ClN3O5S/c1-32-20-9-5-4-8-18(20)26-23(29)15-10-11-21(19(12-15)27(30)31)33-14-22(28)25-13-16-6-2-3-7-17(16)24/h2-12H,13-14H2,1H3,(H,25,28)(H,26,29)