methyl 2,6-bis(azanyl)-5-cyano-4-(4-fluorophenyl)-4H-thiopyran-3-carboxylate

Systemtic Name: methyl 2,6-bis(azanyl)-5-cyano-4-(4-fluorophenyl)-4H-thiopyran-3-carboxylate Openeye Name: methyl 2,6-diamino-5-cyano-4-(4-fluorophenyl)-4H-thiopyran-3-carboxylate CAS Name: 2,6-diamino-5-cyano-4-(4-fluorophenyl)-4H-thiopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2,6-diamino-5-cyano-4-(4-fluorophenyl)-4H-thiopyran-3-carboxylate Traditional Name: 2,6-diamino-5-cyano-4-(4-fluorophenyl)-4H-thiopyran-3-carboxylic acid methyl ester Formula: C14H12FN3O2S MolecularWeight: 305.327383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C(C1C2=CC=C(C=C2)F)C#N)N)N

Isomeric SMILES

COC(=O)C1=C(SC(=C(C1C2=CC=C(C=C2)F)C#N)N)N

InChI

InChI=1S/C14H12FN3O2S/c1-20-14(19)11-10(7-2-4-8(15)5-3-7)9(6-16)12(17)21-13(11)18/h2-5,10H,17-18H2,1H3