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

Systemtic Name: 2-[3-(4-chloranylphenoxy)propylsulfanyl]-3-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-[3-(4-chlorophenoxy)propylsulfanyl]-3-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-[3-(4-chlorophenoxy)propylthio]-3-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-[3-(4-chlorophenoxy)propylsulfanyl]-3-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-[3-(4-chlorophenoxy)propylthio]-3-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C20H21ClN2O2S2 MolecularWeight: 420.97594

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCCCOC3=CC=C(C=C3)Cl)SC4=C2CCCC4

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCCCOC3=CC=C(C=C3)Cl)SC4=C2CCCC4

InChI

InChI=1S/C20H21ClN2O2S2/c1-23-19(24)17-15-5-2-3-6-16(15)27-18(17)22-20(23)26-12-4-11-25-14-9-7-13(21)8-10-14/h7-10H,2-6,11-12H2,1H3