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

Systemtic Name: 3-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-ium-4-amine Openeye Name: 3-butyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-ium-4-amine CAS Name: 3-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-ium-4-amine IUPAC Name: 3-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-ium-4-amine Traditional Name: (3-butyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-ium-4-yl)amine Formula: C14H20N3S+ MolecularWeight: 262.3937

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(C2=C(N=C1)SC3=C2CCCC3)N

Isomeric SMILES

CCCC[N+]1=C(C2=C(N=C1)SC3=C2CCCC3)N

InChI

InChI=1S/C14H19N3S/c1-2-3-8-17-9-16-14-12(13(17)15)10-6-4-5-7-11(10)18-14/h9,15H,2-8H2,1H3/p+1