3-butyl-2-[2-(4-chloranylphenoxy)ethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-butyl-2-[2-(4-chloranylphenoxy)ethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-butyl-2-[2-(4-chlorophenoxy)ethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-butyl-2-[2-(4-chlorophenoxy)ethylthio]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-butyl-2-[2-(4-chlorophenoxy)ethylsulfanyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-butyl-2-[2-(4-chlorophenoxy)ethylthio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H23ClN2O2S2 MolecularWeight: 422.99182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SCCOC3=CC=C(C=C3)Cl)SC(=C2C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SCCOC3=CC=C(C=C3)Cl)SC(=C2C)C

InChI

InChI=1S/C20H23ClN2O2S2/c1-4-5-10-23-19(24)17-13(2)14(3)27-18(17)22-20(23)26-12-11-25-16-8-6-15(21)7-9-16/h6-9H,4-5,10-12H2,1-3H3