[(2S)-1-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1,3-thiazol-4-yl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1,3-thiazol-4-yl]propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)thiazol-4-yl]ethyl]ammonium CAS Name: [(2S)-1-[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-4-thiazolyl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1,3-thiazol-4-yl]propan-2-yl]azanium Traditional Name: [(1S)-1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazino)thiazol-4-yl]ethyl]ammonium Formula: C15H23N5S+2 MolecularWeight: 305.44162

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CSC(=N1)N2CCN(CC2)C3=CC=CC=[NH+]3)[NH3+]

Isomeric SMILES

C[C@@H](CC1=CSC(=N1)N2CCN(CC2)C3=CC=CC=[NH+]3)[NH3+]

InChI

InChI=1S/C15H21N5S/c1-12(16)10-13-11-21-15(18-13)20-8-6-19(7-9-20)14-4-2-3-5-17-14/h2-5,11-12H,6-10,16H2,1H3/p+2/t12-/m0/s1