ethyl 2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)acetate CAS Name: 2-[4-(2-thiazolyl)-1-piperazin-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]acetate Traditional Name: 2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)acetic acid ethyl ester Formula: C11H18N3O2S+ MolecularWeight: 256.34452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[NH+]1CCN(CC1)C2=NC=CS2

Isomeric SMILES

CCOC(=O)C[NH+]1CCN(CC1)C2=NC=CS2

InChI

InChI=1S/C11H17N3O2S/c1-2-16-10(15)9-13-4-6-14(7-5-13)11-12-3-8-17-11/h3,8H,2,4-7,9H2,1H3/p+1