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

Systemtic Name: 2-heptylsulfanyl-5-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Openeye Name: 2-heptylsulfanyl-5-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-amine CAS Name: 2-(heptylthio)-5-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine IUPAC Name: 2-heptylsulfanyl-5-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Traditional Name: [2-(heptylthio)-5-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]amine Formula: C18H27N3S2 MolecularWeight: 349.55708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC(=C2C3=C(CCCC3C)SC2=N1)N

Isomeric SMILES

CCCCCCCSC1=NC(=C2C3=C(CCCC3C)SC2=N1)N

InChI

InChI=1S/C18H27N3S2/c1-3-4-5-6-7-11-22-18-20-16(19)15-14-12(2)9-8-10-13(14)23-17(15)21-18/h12H,3-11H2,1-2H3,(H2,19,20,21)