(E)-2-cyano-3-(4-oxidanylidene-1H-quinolin-3-yl)prop-2-enethioamide

Systemtic Name: (E)-2-cyano-3-(4-oxidanylidene-1H-quinolin-3-yl)prop-2-enethioamide Openeye Name: (E)-2-cyano-3-(4-oxo-1H-quinolin-3-yl)prop-2-enethioamide CAS Name: (E)-2-cyano-3-(4-oxo-1H-quinolin-3-yl)-2-propenethioamide IUPAC Name: (E)-2-cyano-3-(4-oxo-1H-quinolin-3-yl)prop-2-enethioamide Traditional Name: (E)-2-cyano-3-(4-keto-1H-quinolin-3-yl)thioacrylamide Formula: C13H9N3OS MolecularWeight: 255.29506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CN2)C=C(C#N)C(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CN2)/C=C(\C#N)/C(=S)N

InChI

InChI=1S/C13H9N3OS/c14-6-8(13(15)18)5-9-7-16-11-4-2-1-3-10(11)12(9)17/h1-5,7H,(H2,15,18)(H,16,17)/b8-5+