(E)-3-azanyl-2-[(E)-(3-oxidanylidenequinolin-2-ylidene)methyl]-3-sulfanyl-prop-2-enenitrile

Systemtic Name: (E)-3-azanyl-2-[(E)-(3-oxidanylidenequinolin-2-ylidene)methyl]-3-sulfanyl-prop-2-enenitrile Openeye Name: (E)-3-amino-2-[(E)-(3-oxo-2-quinolylidene)methyl]-3-sulfanyl-prop-2-enenitrile CAS Name: (E)-3-amino-3-mercapto-2-[(E)-(3-oxo-2-quinolinylidene)methyl]-2-propenenitrile IUPAC Name: (E)-3-amino-2-[(E)-(3-oxoquinolin-2-ylidene)methyl]-3-sulfanylprop-2-enenitrile Traditional Name: (E)-3-amino-2-[(E)-(3-keto-2-quinolylidene)methyl]-3-mercapto-acrylonitrile Formula: C13H9N3OS MolecularWeight: 255.29506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=O)C(=CC(=C(N)S)C#N)N=C2C=C1

Isomeric SMILES

C1=CC2=CC(=O)/C(=C\C(=C(\N)/S)\C#N)/N=C2C=C1

InChI

InChI=1S/C13H9N3OS/c14-7-9(13(15)18)5-11-12(17)6-8-3-1-2-4-10(8)16-11/h1-6,18H,15H2/b11-5+,13-9+