4-(1-ethyl-2-methylsulfanyl-pteridin-1-ium-4-yl)morpholine

Systemtic Name: 4-(1-ethyl-2-methylsulfanyl-pteridin-1-ium-4-yl)morpholine Openeye Name: 4-(1-ethyl-2-methylsulfanyl-pteridin-1-ium-4-yl)morpholine CAS Name: 4-[1-ethyl-2-(methylthio)-4-pteridin-1-iumyl]morpholine IUPAC Name: 4-(1-ethyl-2-methylsulfanylpteridin-1-ium-4-yl)morpholine Traditional Name: 4-[1-ethyl-2-(methylthio)pteridin-1-ium-4-yl]morpholine Formula: C13H18N5OS+ MolecularWeight: 292.37992

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N=C(C2=NC=CN=C21)N3CCOCC3)SC

Isomeric SMILES

CC[N+]1=C(N=C(C2=NC=CN=C21)N3CCOCC3)SC

InChI

InChI=1S/C13H18N5OS/c1-3-18-11-10(14-4-5-15-11)12(16-13(18)20-2)17-6-8-19-9-7-17/h4-5H,3,6-9H2,1-2H3/q+1