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

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanimidate Openeye Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanimidate CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]ethanimidate IUPAC Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanimidate Traditional Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetimidate Formula: C12H20N4OS MolecularWeight: 268.3784

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)N=C(C[NH+]2CCCC(C2)C)[O-]

Isomeric SMILES

CCC1=NN=C(S1)N=C(C[NH+]2CCC[C@@H](C2)C)[O-]

InChI

InChI=1S/C12H20N4OS/c1-3-11-14-15-12(18-11)13-10(17)8-16-6-4-5-9(2)7-16/h9H,3-8H2,1-2H3,(H,13,15,17)/t9-/m0/s1