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

Systemtic Name: ethyl 6-azanyl-2-[[4-(4-chlorophenyl)-3-cyano-6-thiophen-2-yl-pyridin-2-yl]sulfanylmethyl]-5-cyano-4-thiophen-2-yl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-2-[[4-(4-chlorophenyl)-3-cyano-6-(2-thienyl)-2-pyridyl]sulfanylmethyl]-5-cyano-4-(2-thienyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-2-[[[4-(4-chlorophenyl)-3-cyano-6-thiophen-2-yl-2-pyridinyl]thio]methyl]-5-cyano-4-thiophen-2-yl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-2-[[4-(4-chlorophenyl)-3-cyano-6-thiophen-2-ylpyridin-2-yl]sulfanylmethyl]-5-cyano-4-thiophen-2-yl-4H-pyran-3-carboxylate Traditional Name: 6-amino-2-[[[4-(4-chlorophenyl)-3-cyano-6-(2-thienyl)-2-pyridyl]thio]methyl]-5-cyano-4-(2-thienyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C30H21ClN4O3S3 MolecularWeight: 617.16074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CS2)C#N)N)CSC3=C(C(=CC(=N3)C4=CC=CS4)C5=CC=C(C=C5)Cl)C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=CS2)C#N)N)CSC3=C(C(=CC(=N3)C4=CC=CS4)C5=CC=C(C=C5)Cl)C#N

InChI

InChI=1S/C30H21ClN4O3S3/c1-2-37-30(36)27-23(38-28(34)21(15-33)26(27)25-6-4-12-40-25)16-41-29-20(14-32)19(17-7-9-18(31)10-8-17)13-22(35-29)24-5-3-11-39-24/h3-13,26H,2,16,34H2,1H3