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

Systemtic Name: N-octyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Openeye Name: N-octyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-amine CAS Name: N-octyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine IUPAC Name: N-octyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Traditional Name: octyl(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)amine Formula: C18H27N3S MolecularWeight: 317.49208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C2C3=C(CCCC3)SC2=NC=N1

Isomeric SMILES

CCCCCCCCNC1=C2C3=C(CCCC3)SC2=NC=N1

InChI

InChI=1S/C18H27N3S/c1-2-3-4-5-6-9-12-19-17-16-14-10-7-8-11-15(14)22-18(16)21-13-20-17/h13H,2-12H2,1H3,(H,19,20,21)