[(2S,3S)-3-methyl-1-oxidanylidene-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-3-methyl-1-oxidanylidene-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentan-2-yl]azanium Openeye Name: [(1S,2S)-2-methyl-1-(4-thiazol-2-ylpiperazine-1-carbonyl)butyl]ammonium CAS Name: [(2S,3S)-3-methyl-1-oxo-1-[4-(2-thiazolyl)-1-piperazinyl]pentan-2-yl]ammonium IUPAC Name: [(2S,3S)-3-methyl-1-oxo-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentan-2-yl]azanium Traditional Name: [(1S,2S)-2-methyl-1-(4-thiazol-2-ylpiperazine-1-carbonyl)butyl]ammonium Formula: C13H23N4OS+ MolecularWeight: 283.41292

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C2=NC=CS2)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCN(CC1)C2=NC=CS2)[NH3+]

InChI

InChI=1S/C13H22N4OS/c1-3-10(2)11(14)12(18)16-5-7-17(8-6-16)13-15-4-9-19-13/h4,9-11H,3,5-8,14H2,1-2H3/p+1/t10-,11-/m0/s1