3-[(2-chlorophenyl)methyl]-5-methyl-6-(4-phenylpiperazin-1-yl)carbonyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(4-phenylpiperazin-1-yl)carbonyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(4-phenylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-[oxo-(4-phenyl-1-piperazinyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(4-phenylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-chlorobenzyl)-5-methyl-6-(4-phenylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Formula: C25H23ClN4O2S MolecularWeight: 478.99372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC=C3Cl)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC=C3Cl)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H23ClN4O2S/c1-17-21-23(27-16-30(24(21)31)15-18-7-5-6-10-20(18)26)33-22(17)25(32)29-13-11-28(12-14-29)19-8-3-2-4-9-19/h2-10,16H,11-15H2,1H3