2-methylsulfanyl-4-phenethylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine

Systemtic Name: 2-methylsulfanyl-4-phenethylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Openeye Name: 2-methylsulfanyl-4-phenethylsulfanyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine CAS Name: 2-(methylthio)-4-(phenethylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine IUPAC Name: 2-methylsulfanyl-4-phenethylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Traditional Name: 2-(methylthio)-4-(phenethylthio)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine Formula: C19H20N2S3 MolecularWeight: 372.5705

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C3=C(S2)CCCC3)C(=N1)SCCC4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=C(C3=C(S2)CCCC3)C(=N1)SCCC4=CC=CC=C4

InChI

InChI=1S/C19H20N2S3/c1-22-19-20-17(23-12-11-13-7-3-2-4-8-13)16-14-9-5-6-10-15(14)24-18(16)21-19/h2-4,7-8H,5-6,9-12H2,1H3