methyl 6-azanyl-5-cyano-4-(3,4-dimethoxyphenyl)-4H-thiopyran-3-carboxylate

Systemtic Name: methyl 6-azanyl-5-cyano-4-(3,4-dimethoxyphenyl)-4H-thiopyran-3-carboxylate Openeye Name: methyl 6-amino-5-cyano-4-(3,4-dimethoxyphenyl)-4H-thiopyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(3,4-dimethoxyphenyl)-4H-thiopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-5-cyano-4-(3,4-dimethoxyphenyl)-4H-thiopyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(3,4-dimethoxyphenyl)-4H-thiopyran-3-carboxylic acid methyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=CSC(=C2C#N)N)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=CSC(=C2C#N)N)C(=O)OC)OC

InChI

InChI=1S/C16H16N2O4S/c1-20-12-5-4-9(6-13(12)21-2)14-10(7-17)15(18)23-8-11(14)16(19)22-3/h4-6,8,14H,18H2,1-3H3