N-[2-(4-bromophenyl)sulfanylethyl]-2-[(3-nitrophenyl)amino]ethanamide

Systemtic Name: N-[2-(4-bromophenyl)sulfanylethyl]-2-[(3-nitrophenyl)amino]ethanamide Openeye Name: N-[2-(4-bromophenyl)sulfanylethyl]-2-(3-nitroanilino)acetamide CAS Name: N-[2-[(4-bromophenyl)thio]ethyl]-2-(3-nitroanilino)acetamide IUPAC Name: N-[2-(4-bromophenyl)sulfanylethyl]-2-(3-nitroanilino)acetamide Traditional Name: N-[2-[(4-bromophenyl)thio]ethyl]-2-(3-nitroanilino)acetamide Formula: C16H16BrN3O3S MolecularWeight: 410.28554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NCC(=O)NCCSC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NCC(=O)NCCSC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H16BrN3O3S/c17-12-4-6-15(7-5-12)24-9-8-18-16(21)11-19-13-2-1-3-14(10-13)20(22)23/h1-7,10,19H,8-9,11H2,(H,18,21)