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

Systemtic Name: ethyl 6-azanyl-5-cyano-4-(4-cyanophenyl)-2-[(3-cyano-6-thiophen-2-yl-pyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-(4-cyanophenyl)-2-[[3-cyano-6-(2-thienyl)-2-pyridyl]sulfanylmethyl]-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(4-cyanophenyl)-2-[[(3-cyano-6-thiophen-2-yl-2-pyridinyl)thio]methyl]-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-(4-cyanophenyl)-2-[(3-cyano-6-thiophen-2-ylpyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(4-cyanophenyl)-2-[[[3-cyano-6-(2-thienyl)-2-pyridyl]thio]methyl]-4H-pyran-3-carboxylic acid ethyl ester Formula: C27H19N5O3S2 MolecularWeight: 525.60146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)C#N)C#N)N)CSC3=C(C=CC(=N3)C4=CC=CS4)C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)C#N)C#N)N)CSC3=C(C=CC(=N3)C4=CC=CS4)C#N

InChI

InChI=1S/C27H19N5O3S2/c1-2-34-27(33)24-21(15-37-26-18(13-29)9-10-20(32-26)22-4-3-11-36-22)35-25(31)19(14-30)23(24)17-7-5-16(12-28)6-8-17/h3-11,23H,2,15,31H2,1H3