N-(4-bromophenyl)-2-[2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[2-(2-methoxy-4-nitro-anilino)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(4-bromophenyl)-2-[[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[[2-keto-2-(2-methoxy-4-nitro-anilino)ethyl]thio]acetamide Formula: C17H16BrN3O5S MolecularWeight: 454.29504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSCC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSCC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H16BrN3O5S/c1-26-15-8-13(21(24)25)6-7-14(15)20-17(23)10-27-9-16(22)19-12-4-2-11(18)3-5-12/h2-8H,9-10H2,1H3,(H,19,22)(H,20,23)