6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-ethyl-5-methyl-2-(4-oxo-4-phenyl-butyl)sulfanyl-3-(p-tolylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-2-[(4-oxo-4-phenylbutyl)thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-2-(4-oxo-4-phenylbutyl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 6-ethyl-2-[(4-keto-4-phenyl-butyl)thio]-5-methyl-3-(4-methylbenzyl)thieno[2,3-d]pyrimidin-4-one Formula: C27H28N2O2S2 MolecularWeight: 476.65342

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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)SCCCC(=O)C4=CC=CC=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O2S2/c1-4-23-19(3)24-25(33-23)28-27(29(26(24)31)17-20-14-12-18(2)13-15-20)32-16-8-11-22(30)21-9-6-5-7-10-21/h5-7,9-10,12-15H,4,8,11,16-17H2,1-3H3