5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-N-[(3S)-thiolan-3-yl]pyridin-1-ium-2-amine

Systemtic Name: 5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-N-[(3S)-thiolan-3-yl]pyridin-1-ium-2-amine Openeye Name: 5-(3-isopropyl-1,2,4-oxadiazol-5-yl)-N-[(3S)-tetrahydrothiophen-3-yl]pyridin-1-ium-2-amine CAS Name: 5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-N-[(3S)-3-thiolanyl]-2-pyridin-1-iumamine IUPAC Name: 5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-N-[(3S)-thiolan-3-yl]pyridin-1-ium-2-amine Traditional Name: [5-(3-isopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-[(3S)-tetrahydrothiophen-3-yl]amine Formula: C14H19N4OS+ MolecularWeight: 291.39186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)C2=C[NH+]=C(C=C2)NC3CCSC3

Isomeric SMILES

CC(C)C1=NOC(=N1)C2=C[NH+]=C(C=C2)N[C@H]3CCSC3

InChI

InChI=1S/C14H18N4OS/c1-9(2)13-17-14(19-18-13)10-3-4-12(15-7-10)16-11-5-6-20-8-11/h3-4,7,9,11H,5-6,8H2,1-2H3,(H,15,16)/p+1/t11-/m0/s1