2-[(4-tert-butylphenyl)methylsulfanyl]-6-ethyl-3-(3-methoxyphenyl)-5-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-ethyl-3-(3-methoxyphenyl)-5-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-ethyl-3-(3-methoxyphenyl)-5-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-6-ethyl-3-(3-methoxyphenyl)-5-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-ethyl-3-(3-methoxyphenyl)-5-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-6-ethyl-3-(3-methoxyphenyl)-5-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C27H30N2O2S2 MolecularWeight: 478.6693

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=C(N(C2=O)C3=CC(=CC=C3)OC)SCC4=CC=C(C=C4)C(C)(C)C)C

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(N(C2=O)C3=CC(=CC=C3)OC)SCC4=CC=C(C=C4)C(C)(C)C)C

InChI

InChI=1S/C27H30N2O2S2/c1-7-22-17(2)23-24(33-22)28-26(29(25(23)30)20-9-8-10-21(15-20)31-6)32-16-18-11-13-19(14-12-18)27(3,4)5/h8-15H,7,16H2,1-6H3