ethyl 6-azanyl-4-(2-bromophenyl)-5-cyano-2-[(3-cyano-6-thiophen-2-yl-pyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-(2-bromophenyl)-5-cyano-2-[(3-cyano-6-thiophen-2-yl-pyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(2-bromophenyl)-5-cyano-2-[[3-cyano-6-(2-thienyl)-2-pyridyl]sulfanylmethyl]-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(2-bromophenyl)-5-cyano-2-[[(3-cyano-6-thiophen-2-yl-2-pyridinyl)thio]methyl]-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(2-bromophenyl)-5-cyano-2-[(3-cyano-6-thiophen-2-ylpyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(2-bromophenyl)-5-cyano-2-[[[3-cyano-6-(2-thienyl)-2-pyridyl]thio]methyl]-4H-pyran-3-carboxylic acid ethyl ester Formula: C26H19BrN4O3S2 MolecularWeight: 579.48806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2Br)C#N)N)CSC3=C(C=CC(=N3)C4=CC=CS4)C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2Br)C#N)N)CSC3=C(C=CC(=N3)C4=CC=CS4)C#N

InChI

InChI=1S/C26H19BrN4O3S2/c1-2-33-26(32)23-20(34-24(30)17(13-29)22(23)16-6-3-4-7-18(16)27)14-36-25-15(12-28)9-10-19(31-25)21-8-5-11-35-21/h3-11,22H,2,14,30H2,1H3