(E)-2-cyano-3-(2-oxidanylidenechromen-3-yl)prop-2-enethioamide

Systemtic Name: (E)-2-cyano-3-(2-oxidanylidenechromen-3-yl)prop-2-enethioamide Openeye Name: (E)-2-cyano-3-(2-oxochromen-3-yl)prop-2-enethioamide CAS Name: (E)-2-cyano-3-(2-oxo-1-benzopyran-3-yl)-2-propenethioamide IUPAC Name: (E)-2-cyano-3-(2-oxochromen-3-yl)prop-2-enethioamide Traditional Name: (E)-2-cyano-3-(2-ketochromen-3-yl)thioacrylamide Formula: C13H8N2O2S MolecularWeight: 256.27982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C=C(C#N)C(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)/C=C(\C#N)/C(=S)N

InChI

InChI=1S/C13H8N2O2S/c14-7-10(12(15)18)6-9-5-8-3-1-2-4-11(8)17-13(9)16/h1-6H,(H2,15,18)/b10-6+