(3R)-3-piperazin-4-ium-1-ylthiolane-3-carbonitrile

Systemtic Name: (3R)-3-piperazin-4-ium-1-ylthiolane-3-carbonitrile Openeye Name: (3R)-3-piperazin-4-ium-1-yltetrahydrothiophene-3-carbonitrile CAS Name: (3R)-3-(1-piperazin-4-iumyl)-3-thiolanecarbonitrile IUPAC Name: (3R)-3-piperazin-4-ium-1-ylthiolane-3-carbonitrile Traditional Name: (3R)-3-piperazin-4-ium-1-yltetrahydrothiophene-3-carbonitrile Formula: C9H16N3S+ MolecularWeight: 198.30844

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1(C#N)N2CC[NH2+]CC2

Isomeric SMILES

C1CSC[C@@]1(C#N)N2CC[NH2+]CC2

InChI

InChI=1S/C9H15N3S/c10-7-9(1-6-13-8-9)12-4-2-11-3-5-12/h11H,1-6,8H2/p+1/t9-/m1/s1