(E)-3-azanyl-2-cyano-N-(4-nitrophenyl)but-2-enethioamide

Systemtic Name: (E)-3-azanyl-2-cyano-N-(4-nitrophenyl)but-2-enethioamide Openeye Name: (E)-3-amino-2-cyano-N-(4-nitrophenyl)but-2-enethioamide CAS Name: (E)-3-amino-2-cyano-N-(4-nitrophenyl)-2-butenethioamide IUPAC Name: (E)-3-amino-2-cyano-N-(4-nitrophenyl)but-2-enethioamide Traditional Name: (E)-3-amino-2-cyano-N-(4-nitrophenyl)but-2-enethioamide Formula: C11H10N4O2S MolecularWeight: 262.2877

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C(/C#N)\C(=S)NC1=CC=C(C=C1)[N+](=O)[O-])/N

InChI

InChI=1S/C11H10N4O2S/c1-7(13)10(6-12)11(18)14-8-2-4-9(5-3-8)15(16)17/h2-5H,13H2,1H3,(H,14,18)/b10-7+