methyl 6-azanyl-4-(5-bromanylthiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: methyl 6-azanyl-4-(5-bromanylthiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-4-(5-bromo-2-thienyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(5-bromo-2-thiophenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-4-(5-bromothiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(5-bromo-2-thienyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid methyl ester Formula: C13H11BrN2O3S MolecularWeight: 355.20704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(S2)Br)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(S2)Br)C(=O)OC

InChI

InChI=1S/C13H11BrN2O3S/c1-6-10(13(17)18-2)11(7(5-15)12(16)19-6)8-3-4-9(14)20-8/h3-4,11H,16H2,1-2H3