5-ethyl-6-methyl-2-[(4-methylphenyl)methylsulfanyl]-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-ethyl-6-methyl-2-[(4-methylphenyl)methylsulfanyl]-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-ethyl-6-methyl-2-(p-tolylmethylsulfanyl)-3-(tetrahydrofuran-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-2-[(4-methylphenyl)methylthio]-3-(2-oxolanylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-ethyl-6-methyl-2-[(4-methylphenyl)methylsulfanyl]-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-ethyl-6-methyl-2-[(4-methylbenzyl)thio]-3-(tetrahydrofurfuryl)thieno[2,3-d]pyrimidin-4-one Formula: C22H26N2O2S2 MolecularWeight: 414.58404

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)C)CC4CCCO4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)C)CC4CCCO4)C

InChI

InChI=1S/C22H26N2O2S2/c1-4-18-15(3)28-20-19(18)21(25)24(12-17-6-5-11-26-17)22(23-20)27-13-16-9-7-14(2)8-10-16/h7-10,17H,4-6,11-13H2,1-3H3