[(2S,4R)-4-oxidanylpyrrolidin-1-ium-2-yl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: [(2S,4R)-4-oxidanylpyrrolidin-1-ium-2-yl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone Openeye Name: [(2S,4R)-4-hydroxypyrrolidin-1-ium-2-yl]-(4-thiazol-2-ylpiperazin-1-yl)methanone CAS Name: [(2S,4R)-4-hydroxy-2-pyrrolidin-1-iumyl]-[4-(2-thiazolyl)-1-piperazinyl]methanone IUPAC Name: [(2S,4R)-4-hydroxypyrrolidin-1-ium-2-yl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone Traditional Name: [(2S,4R)-4-hydroxypyrrolidin-1-ium-2-yl]-(4-thiazol-2-ylpiperazino)methanone Formula: C12H19N4O2S+ MolecularWeight: 283.36986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CS2)C(=O)C3CC(C[NH2+]3)O

Isomeric SMILES

C1CN(CCN1C2=NC=CS2)C(=O)[C@@H]3C[C@H](C[NH2+]3)O

InChI

InChI=1S/C12H18N4O2S/c17-9-7-10(14-8-9)11(18)15-2-4-16(5-3-15)12-13-1-6-19-12/h1,6,9-10,14,17H,2-5,7-8H2/p+1/t9-,10+/m1/s1