5-ethyl-6-methyl-2-[4-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-ethyl-6-methyl-2-[4-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-ethyl-6-methyl-2-[4-[4-(m-tolylsulfonyl)piperazine-1-carbonyl]phenyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-2-[4-[[4-(3-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-ethyl-6-methyl-2-[4-[4-(3-methylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-ethyl-6-methyl-2-[4-[4-(m-tolylsulfonyl)piperazine-1-carbonyl]phenyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C27H28N4O4S2 MolecularWeight: 536.66562

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)NC(=N2)C3=CC=C(C=C3)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC(=C5)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)NC(=N2)C3=CC=C(C=C3)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC(=C5)C)C

InChI

InChI=1S/C27H28N4O4S2/c1-4-22-18(3)36-26-23(22)25(32)28-24(29-26)19-8-10-20(11-9-19)27(33)30-12-14-31(15-13-30)37(34,35)21-7-5-6-17(2)16-21/h5-11,16H,4,12-15H2,1-3H3,(H,28,29,32)