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

Systemtic Name: 7-tert-butyl-2-heptylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-tert-butyl-2-heptylsulfanyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-amine CAS Name: 7-tert-butyl-2-(heptylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine IUPAC Name: 7-tert-butyl-2-heptylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Traditional Name: [7-tert-butyl-2-(heptylthio)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]amine Formula: C21H33N3S2 MolecularWeight: 391.63682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC(=C2C3=C(CC(CC3)C(C)(C)C)SC2=N1)N

Isomeric SMILES

CCCCCCCSC1=NC(=C2C3=C(CC(CC3)C(C)(C)C)SC2=N1)N

InChI

InChI=1S/C21H33N3S2/c1-5-6-7-8-9-12-25-20-23-18(22)17-15-11-10-14(21(2,3)4)13-16(15)26-19(17)24-20/h14H,5-13H2,1-4H3,(H2,22,23,24)