3-(4-bromanyl-3-nitro-phenyl)-2-cyano-prop-2-enethioamide

Systemtic Name: 3-(4-bromanyl-3-nitro-phenyl)-2-cyano-prop-2-enethioamide Openeye Name: 3-(4-bromo-3-nitro-phenyl)-2-cyano-prop-2-enethioamide CAS Name: 3-(4-bromo-3-nitrophenyl)-2-cyano-2-propenethioamide IUPAC Name: 3-(4-bromo-3-nitrophenyl)-2-cyanoprop-2-enethioamide Traditional Name: 3-(4-bromo-3-nitro-phenyl)-2-cyano-thioacrylamide Formula: C10H6BrN3O2S MolecularWeight: 312.14254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=C(C#N)C(=S)N)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1C=C(C#N)C(=S)N)[N+](=O)[O-])Br

InChI

InChI=1S/C10H6BrN3O2S/c11-8-2-1-6(4-9(8)14(15)16)3-7(5-12)10(13)17/h1-4H,(H2,13,17)