N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-2-(4-methylsulfanyl-3-nitro-benzoyl)benzamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]benzamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-2-(4-methylsulfanyl-3-nitrobenzoyl)benzamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-2-[4-(methylthio)-3-nitro-benzoyl]benzamide Formula: C23H18BrN3O5S MolecularWeight: 528.37512

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCC(=O)NC3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCC(=O)NC3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C23H18BrN3O5S/c1-33-20-11-10-14(12-19(20)27(31)32)22(29)15-6-2-3-7-16(15)23(30)25-13-21(28)26-18-9-5-4-8-17(18)24/h2-12H,13H2,1H3,(H,25,30)(H,26,28)