5-(4-tert-butylphenyl)-6-ethyl-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-tert-butylphenyl)-6-ethyl-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzyl-5-(4-tert-butylphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-tert-butylphenyl)-6-ethyl-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-benzyl-5-(4-tert-butylphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-benzyl-5-(4-tert-butylphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C25H26N2OS MolecularWeight: 402.55174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=C(NC2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(NC2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C25H26N2OS/c1-5-19-21(17-11-13-18(14-12-17)25(2,3)4)22-23(28)26-20(27-24(22)29-19)15-16-9-7-6-8-10-16/h6-14H,5,15H2,1-4H3,(H,26,27,28)