N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-piperidin-1-ium-1-yl-ethanimidate

Systemtic Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-piperidin-1-ium-1-yl-ethanimidate Openeye Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-piperidin-1-ium-1-yl-ethanimidate CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(1-piperidin-1-iumyl)ethanimidate IUPAC Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-piperidin-1-ium-1-ylethanimidate Traditional Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-piperidin-1-ium-1-yl-acetimidate Formula: C12H18N4OS MolecularWeight: 266.36252

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=NC2=NN=C(S2)C3CC3)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CC(=NC2=NN=C(S2)C3CC3)[O-]

InChI

InChI=1S/C12H18N4OS/c17-10(8-16-6-2-1-3-7-16)13-12-15-14-11(18-12)9-4-5-9/h9H,1-8H2,(H,13,15,17)