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

Systemtic Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(4-propylpiperazin-1-yl)carbonyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(4-propylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-[oxo-(4-propyl-1-piperazinyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(4-propylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-chlorobenzyl)-5-methyl-6-(4-propylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H25ClN4O2S MolecularWeight: 444.9775

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C2=C(C3=C(S2)N=CN(C3=O)CC4=CC=CC=C4Cl)C

Isomeric SMILES

CCCN1CCN(CC1)C(=O)C2=C(C3=C(S2)N=CN(C3=O)CC4=CC=CC=C4Cl)C

InChI

InChI=1S/C22H25ClN4O2S/c1-3-8-25-9-11-26(12-10-25)22(29)19-15(2)18-20(30-19)24-14-27(21(18)28)13-16-6-4-5-7-17(16)23/h4-7,14H,3,8-13H2,1-2H3