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

Systemtic Name: 5-(4-tert-butylphenyl)-2-[(3-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-tert-butylphenyl)-2-[(3-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-tert-butylphenyl)-2-[(3-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-tert-butylphenyl)-2-[(3-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-tert-butylphenyl)-2-(3-chlorobenzyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C24H23ClN2OS MolecularWeight: 422.97022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)CC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)CC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C24H23ClN2OS/c1-14-20(16-8-10-17(11-9-16)24(2,3)4)21-22(28)26-19(27-23(21)29-14)13-15-6-5-7-18(25)12-15/h5-12H,13H2,1-4H3,(H,26,27,28)