2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate Openeye Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate CAS Name: 2-[(3S)-3-methyl-1-piperidin-1-iumyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate IUPAC Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate Traditional Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetimidate Formula: C13H22N4OS MolecularWeight: 282.40498

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)N=C(C[NH+]2CCCC(C2)C)[O-]

Isomeric SMILES

CCCC1=NN=C(S1)N=C(C[NH+]2CCC[C@@H](C2)C)[O-]

InChI

InChI=1S/C13H22N4OS/c1-3-5-12-15-16-13(19-12)14-11(18)9-17-7-4-6-10(2)8-17/h10H,3-9H2,1-2H3,(H,14,16,18)/t10-/m0/s1