N-[2-(2-cyanoethylsulfanyl)phenyl]-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-5-nitro-thiophene-2-carboxamide Openeye Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-5-nitro-thiophene-2-carboxamide CAS Name: N-[2-(2-cyanoethylthio)phenyl]-5-nitro-2-thiophenecarboxamide IUPAC Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-5-nitrothiophene-2-carboxamide Traditional Name: N-[2-(2-cyanoethylthio)phenyl]-5-nitro-thiophene-2-carboxamide Formula: C14H11N3O3S2 MolecularWeight: 333.38544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC=C(S2)[N+](=O)[O-])SCCC#N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC=C(S2)[N+](=O)[O-])SCCC#N

InChI

InChI=1S/C14H11N3O3S2/c15-8-3-9-21-11-5-2-1-4-10(11)16-14(18)12-6-7-13(22-12)17(19)20/h1-2,4-7H,3,9H2,(H,16,18)