(phenylmethyl) 2-[(3-cyclohexyl-6-methyl-4-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[(3-cyclohexyl-6-methyl-4-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: benzyl 2-[(3-cyclohexyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(3-cyclohexyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(3-cyclohexyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(3-cyclohexyl-4-keto-6-methyl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)thio]acetic acid benzyl ester Formula: C22H26N2O3S2 MolecularWeight: 430.58344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(S1)C(=O)N(C(=N2)SCC(=O)OCC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CC1CC2=C(S1)C(=O)N(C(=N2)SCC(=O)OCC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C22H26N2O3S2/c1-15-12-18-20(29-15)21(26)24(17-10-6-3-7-11-17)22(23-18)28-14-19(25)27-13-16-8-4-2-5-9-16/h2,4-5,8-9,15,17H,3,6-7,10-14H2,1H3