N-(2,4-dimethylphenyl)-2-[(4-ethanoylpiperazin-1-yl)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-[(4-ethanoylpiperazin-1-yl)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-[(4-acetylpiperazin-1-yl)methyl]-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-[(4-acetyl-1-piperazinyl)methyl]-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: 2-[(4-acetylpiperazin-1-yl)methyl]-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-[(4-acetylpiperazino)methyl]-N-(2,4-dimethylphenyl)-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(NC3=O)CN4CCN(CC4)C(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(NC3=O)CN4CCN(CC4)C(=O)C)C)C

InChI

InChI=1S/C23H27N5O3S/c1-13-5-6-17(14(2)11-13)24-22(31)20-15(3)19-21(30)25-18(26-23(19)32-20)12-27-7-9-28(10-8-27)16(4)29/h5-6,11H,7-10,12H2,1-4H3,(H,24,31)(H,25,26,30)