3-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-tert-butyl-2,6-dimethyl-benzyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CN2C=NC3=C(C2=O)C(=C(S3)C)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CN2C=NC3=C(C2=O)C(=C(S3)C)C)C)C(C)(C)C

InChI

InChI=1S/C21H26N2OS/c1-12-8-16(21(5,6)7)9-13(2)17(12)10-23-11-22-19-18(20(23)24)14(3)15(4)25-19/h8-9,11H,10H2,1-7H3