cyclohexyl 2-[4-oxidanylidene-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: cyclohexyl 2-[4-oxidanylidene-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: cyclohexyl 2-[4-oxo-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 2-[4-oxo-5-(4-propoxyphenyl)-3-thieno[2,3-d]pyrimidinyl]propanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[4-oxo-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 2-[4-keto-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]propionic acid cyclohexyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)C(C)C(=O)OC4CCCCC4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)C(C)C(=O)OC4CCCCC4

InChI

InChI=1S/C24H28N2O4S/c1-3-13-29-18-11-9-17(10-12-18)20-14-31-22-21(20)23(27)26(15-25-22)16(2)24(28)30-19-7-5-4-6-8-19/h9-12,14-16,19H,3-8,13H2,1-2H3