(4-tert-butylcyclohexyl) 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate

Systemtic Name: (4-tert-butylcyclohexyl) 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: (4-tert-butylcyclohexyl) 2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)acetic acid (4-tert-butylcyclohexyl) ester IUPAC Name: (4-tert-butylcyclohexyl) 2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid (4-tert-butylcyclohexyl) ester Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N2O3S/c1-24(2,3)17-9-11-18(12-10-17)29-20(27)13-26-15-25-22-21(23(26)28)19(14-30-22)16-7-5-4-6-8-16/h4-8,14-15,17-18H,9-13H2,1-3H3