3-butyl-2-heptylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-butyl-2-heptylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-butyl-2-heptylsulfanyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-butyl-2-(heptylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-butyl-2-heptylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-butyl-2-(heptylthio)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C21H32N2OS2 MolecularWeight: 392.62158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CCCC

Isomeric SMILES

CCCCCCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CCCC

InChI

InChI=1S/C21H32N2OS2/c1-3-5-7-8-11-15-25-21-22-19-18(20(24)23(21)14-6-4-2)16-12-9-10-13-17(16)26-19/h3-15H2,1-2H3