2-[(4-chlorophenyl)methylsulfanyl]-3,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-3,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-3,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-3,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-3,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-3,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C15H13ClN2OS2 MolecularWeight: 336.85952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC2=C(S1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H13ClN2OS2/c1-9-7-12-13(21-9)17-15(18(2)14(12)19)20-8-10-3-5-11(16)6-4-10/h3-7H,8H2,1-2H3