(3-methylcyclohexyl) 2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name: (3-methylcyclohexyl) 2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: (3-methylcyclohexyl) 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)thio]acetic acid (3-methylcyclohexyl) ester IUPAC Name: (3-methylcyclohexyl) 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]acetic acid (3-methylcyclohexyl) ester Formula: C17H22N2O3S2 MolecularWeight: 366.49818

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)OC(=O)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2

Isomeric SMILES

CC1CCCC(C1)OC(=O)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2

InChI

InChI=1S/C17H22N2O3S2/c1-9-5-4-6-12(7-9)22-13(20)8-23-17-18-15(21)14-10(2)11(3)24-16(14)19-17/h9,12H,4-8H2,1-3H3,(H,18,19,21)