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

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-ethyl-5-methyl-3-(p-tolylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-6-ethyl-5-methyl-3-(4-methylbenzyl)thieno[2,3-d]pyrimidin-4-one Formula: C28H32N2OS2 MolecularWeight: 476.69648

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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)SCC4=CC=C(C=C4)C(C)(C)C)C

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)C)SCC4=CC=C(C=C4)C(C)(C)C)C

InChI

InChI=1S/C28H32N2OS2/c1-7-23-19(3)24-25(33-23)29-27(30(26(24)31)16-20-10-8-18(2)9-11-20)32-17-21-12-14-22(15-13-21)28(4,5)6/h8-15H,7,16-17H2,1-6H3