(4-methylcyclohexyl) 2-(2-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate

Systemtic Name: (4-methylcyclohexyl) 2-(2-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: (4-methylcyclohexyl) 2-(2-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(2-methyl-4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)acetic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) 2-(2-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid (4-methylcyclohexyl) ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC(=O)CN2C(=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)C

Isomeric SMILES

CC1CCC(CC1)OC(=O)CN2C(=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H24N2O3S/c1-14-8-10-17(11-9-14)27-20(25)13-24-15(2)23-21-18(22(24)26)12-19(28-21)16-6-4-3-5-7-16/h3-7,12,14,17H,8-11,13H2,1-2H3