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

Systemtic Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(2-methylpiperidin-1-yl)carbonyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(2-methylpiperidine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-[(2-methyl-1-piperidinyl)-oxomethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(2-chlorophenyl)methyl]-5-methyl-6-(2-methylpiperidine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-chlorobenzyl)-5-methyl-6-(2-methylpiperidine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=C(C3=C(S2)N=CN(C3=O)CC4=CC=CC=C4Cl)C

Isomeric SMILES

CC1CCCCN1C(=O)C2=C(C3=C(S2)N=CN(C3=O)CC4=CC=CC=C4Cl)C

InChI

InChI=1S/C21H22ClN3O2S/c1-13-7-5-6-10-25(13)21(27)18-14(2)17-19(28-18)23-12-24(20(17)26)11-15-8-3-4-9-16(15)22/h3-4,8-9,12-13H,5-7,10-11H2,1-2H3