N-[4-(2-cyano-4-nitro-phenyl)sulfanylphenyl]ethanamide

Systemtic Name: N-[4-(2-cyano-4-nitro-phenyl)sulfanylphenyl]ethanamide Openeye Name: N-[4-(2-cyano-4-nitro-phenyl)sulfanylphenyl]acetamide CAS Name: N-[4-[(2-cyano-4-nitrophenyl)thio]phenyl]acetamide IUPAC Name: N-[4-(2-cyano-4-nitrophenyl)sulfanylphenyl]acetamide Traditional Name: N-[4-[(2-cyano-4-nitro-phenyl)thio]phenyl]acetamide Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H11N3O3S/c1-10(19)17-12-2-5-14(6-3-12)22-15-7-4-13(18(20)21)8-11(15)9-16/h2-8H,1H3,(H,17,19)