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

Systemtic Name: cyclohexyl 2-[5-(4-methoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: cyclohexyl 2-[5-(4-methoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 2-[5-(4-methoxyphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[5-(4-methoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 2-[4-keto-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]propionic acid cyclohexyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CCCCC1)N2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C(=O)OC1CCCCC1)N2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H24N2O4S/c1-14(22(26)28-17-6-4-3-5-7-17)24-13-23-20-19(21(24)25)18(12-29-20)15-8-10-16(27-2)11-9-15/h8-14,17H,3-7H2,1-2H3