2-[2-(4-chloranylphenoxy)ethylsulfanyl]-3-cyclopentyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(4-chloranylphenoxy)ethylsulfanyl]-3-cyclopentyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-3-cyclopentyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-[2-(4-chlorophenoxy)ethylthio]-3-cyclopentyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-3-cyclopentyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-[2-(4-chlorophenoxy)ethylthio]-3-cyclopentyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C23H25ClN2O2S2 MolecularWeight: 461.0398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=C(N=C2SCCOC4=CC=C(C=C4)Cl)SC5=C3CCCC5

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=C(N=C2SCCOC4=CC=C(C=C4)Cl)SC5=C3CCCC5

InChI

InChI=1S/C23H25ClN2O2S2/c24-15-9-11-17(12-10-15)28-13-14-29-23-25-21-20(18-7-3-4-8-19(18)30-21)22(27)26(23)16-5-1-2-6-16/h9-12,16H,1-8,13-14H2