methyl 4-[2,6-bis(azanyl)-3,5-dicyano-4H-thiopyran-4-yl]benzoate

Systemtic Name: methyl 4-[2,6-bis(azanyl)-3,5-dicyano-4H-thiopyran-4-yl]benzoate Openeye Name: methyl 4-(2,6-diamino-3,5-dicyano-4H-thiopyran-4-yl)benzoate CAS Name: 4-(2,6-diamino-3,5-dicyano-4H-thiopyran-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(2,6-diamino-3,5-dicyano-4H-thiopyran-4-yl)benzoate Traditional Name: 4-(2,6-diamino-3,5-dicyano-4H-thiopyran-4-yl)benzoic acid methyl ester Formula: C15H12N4O2S MolecularWeight: 312.34638

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(=C(SC(=C2C#N)N)N)C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C(=C(SC(=C2C#N)N)N)C#N

InChI

InChI=1S/C15H12N4O2S/c1-21-15(20)9-4-2-8(3-5-9)12-10(6-16)13(18)22-14(19)11(12)7-17/h2-5,12H,18-19H2,1H3