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

Systemtic Name: ethyl 6-azanyl-4-(5-bromanylthiophen-2-yl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(5-bromo-2-thienyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(5-bromo-2-thiophenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(5-bromothiophen-2-yl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(5-bromo-2-thienyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylic acid ethyl ester Formula: C14H12BrClN2O3S MolecularWeight: 403.67868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(S2)Br)C#N)N)CCl

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(S2)Br)C#N)N)CCl

InChI

InChI=1S/C14H12BrClN2O3S/c1-2-20-14(19)12-8(5-16)21-13(18)7(6-17)11(12)9-3-4-10(15)22-9/h3-4,11H,2,5,18H2,1H3