5-(4-tert-butylphenyl)-3-(2,5-dimethylpyrrol-1-yl)-2-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-tert-butylphenyl)-3-(2,5-dimethylpyrrol-1-yl)-2-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-tert-butylphenyl)-3-(2,5-dimethylpyrrol-1-yl)-2-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-tert-butylphenyl)-3-(2,5-dimethyl-1-pyrrolyl)-2-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-tert-butylphenyl)-3-(2,5-dimethylpyrrol-1-yl)-2-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-tert-butylphenyl)-3-(2,5-dimethylpyrrol-1-yl)-2-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1N2C(=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)C(C)(C)C)C)C

Isomeric SMILES

CC1=CC=C(N1N2C(=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)C(C)(C)C)C)C

InChI

InChI=1S/C23H25N3OS/c1-14-7-8-15(2)25(14)26-16(3)24-21-20(22(26)27)19(13-28-21)17-9-11-18(12-10-17)23(4,5)6/h7-13H,1-6H3