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

Systemtic Name: 6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-2-(2-methylpropylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-ethyl-2-isobutylsulfanyl-5-methyl-3-(p-tolylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-2-(2-methylpropylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-2-(2-methylpropylsulfanyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-ethyl-2-(isobutylthio)-5-methyl-3-(4-methylbenzyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H26N2OS2 MolecularWeight: 386.57394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)C)SCC(C)C)C

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)C)SCC(C)C)C

InChI

InChI=1S/C21H26N2OS2/c1-6-17-15(5)18-19(26-17)22-21(25-12-13(2)3)23(20(18)24)11-16-9-7-14(4)8-10-16/h7-10,13H,6,11-12H2,1-5H3