methyl (2Z)-2-(6-azanyl-5-cyano-4-phenyl-thiopyran-2-ylidene)-2-cyano-ethanoate

Systemtic Name: methyl (2Z)-2-(6-azanyl-5-cyano-4-phenyl-thiopyran-2-ylidene)-2-cyano-ethanoate Openeye Name: methyl (2Z)-2-(6-amino-5-cyano-4-phenyl-thiopyran-2-ylidene)-2-cyano-acetate CAS Name: (2Z)-2-(6-amino-5-cyano-4-phenyl-2-thiopyranylidene)-2-cyanoacetic acid methyl ester IUPAC Name: methyl (2Z)-2-(6-amino-5-cyano-4-phenylthiopyran-2-ylidene)-2-cyanoacetate Traditional Name: (2Z)-2-(6-amino-5-cyano-4-phenyl-thiopyran-2-ylidene)-2-cyano-acetic acid methyl ester Formula: C16H11N3O2S MolecularWeight: 309.34244

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1C=C(C(=C(S1)N)C#N)C2=CC=CC=C2)C#N

Isomeric SMILES

COC(=O)/C(=C\1/C=C(C(=C(S1)N)C#N)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C16H11N3O2S/c1-21-16(20)13(9-18)14-7-11(10-5-3-2-4-6-10)12(8-17)15(19)22-14/h2-7H,19H2,1H3/b14-13-