5,6-dimethyl-2-[(2-methylphenyl)methylsulfanyl]-3-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(2-methylphenyl)methylsulfanyl]-3-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(o-tolylmethylsulfanyl)-3-(3-pyridylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(2-methylphenyl)methylthio]-3-(3-pyridinylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-[(2-methylphenyl)methylsulfanyl]-3-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(2-methylbenzyl)thio]-3-(3-pyridylmethyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H21N3OS2 MolecularWeight: 407.55164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2CC4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2CC4=CN=CC=C4

InChI

InChI=1S/C22H21N3OS2/c1-14-7-4-5-9-18(14)13-27-22-24-20-19(15(2)16(3)28-20)21(26)25(22)12-17-8-6-10-23-11-17/h4-11H,12-13H2,1-3H3