3-[(Z)-(4-oxidanylidenethiochromen-3-ylidene)methyl]benzenecarbonitrile

Systemtic Name: 3-[(Z)-(4-oxidanylidenethiochromen-3-ylidene)methyl]benzenecarbonitrile Openeye Name: 3-[(Z)-(4-oxothiochroman-3-ylidene)methyl]benzonitrile CAS Name: 3-[(Z)-(4-oxo-1-benzothiopyran-3-ylidene)methyl]benzonitrile IUPAC Name: 3-[(Z)-(4-oxothiochromen-3-ylidene)methyl]benzonitrile Traditional Name: 3-[(Z)-(4-ketothiochroman-3-ylidene)methyl]benzonitrile Formula: C17H11NOS MolecularWeight: 277.34034

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=CC(=C2)C#N)C(=O)C3=CC=CC=C3S1

Isomeric SMILES

C1/C(=C\C2=CC=CC(=C2)C#N)/C(=O)C3=CC=CC=C3S1

InChI

InChI=1S/C17H11NOS/c18-10-13-5-3-4-12(8-13)9-14-11-20-16-7-2-1-6-15(16)17(14)19/h1-9H,11H2/b14-9+