methyl 5-[5-[[5-cyano-4-oxidanylidene-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanyl]pentyl]thiophene-2-carboxylate

Systemtic Name: methyl 5-[5-[[5-cyano-4-oxidanylidene-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanyl]pentyl]thiophene-2-carboxylate Openeye Name: methyl 5-[5-[[5-cyano-4-oxo-6-[5-(2-thienyl)-2-thienyl]-1H-pyrimidin-2-yl]sulfanyl]pentyl]thiophene-2-carboxylate CAS Name: 5-[5-[[5-cyano-4-oxo-6-(5-thiophen-2-yl-2-thiophenyl)-1H-pyrimidin-2-yl]thio]pentyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[5-[[5-cyano-4-oxo-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanyl]pentyl]thiophene-2-carboxylate Traditional Name: 5-[5-[[5-cyano-4-keto-6-[5-(2-thienyl)-2-thienyl]-1H-pyrimidin-2-yl]thio]pentyl]thiophene-2-carboxylic acid methyl ester Formula: C24H21N3O3S4 MolecularWeight: 527.70184

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)CCCCCSC2=NC(=O)C(=C(N2)C3=CC=C(S3)C4=CC=CS4)C#N

Isomeric SMILES

COC(=O)C1=CC=C(S1)CCCCCSC2=NC(=O)C(=C(N2)C3=CC=C(S3)C4=CC=CS4)C#N

InChI

InChI=1S/C24H21N3O3S4/c1-30-23(29)20-9-8-15(33-20)6-3-2-4-12-32-24-26-21(16(14-25)22(28)27-24)19-11-10-18(34-19)17-7-5-13-31-17/h5,7-11,13H,2-4,6,12H2,1H3,(H,26,27,28)