2-hexylsulfanyl-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-hexylsulfanyl-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-hexylsulfanyl-7-methyl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-(hexylthio)-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-hexylsulfanyl-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-(hexylthio)-7-methyl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C17H24N2OS2 MolecularWeight: 336.51526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=C(C3=C(S2)CC(CC3)C)C(=O)N1

Isomeric SMILES

CCCCCCSC1=NC2=C(C3=C(S2)CC(CC3)C)C(=O)N1

InChI

InChI=1S/C17H24N2OS2/c1-3-4-5-6-9-21-17-18-15(20)14-12-8-7-11(2)10-13(12)22-16(14)19-17/h11H,3-10H2,1-2H3,(H,18,19,20)