[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-[[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]methyl]azanium

Systemtic Name: [(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-[[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]methyl]azanium Openeye Name: [(1S)-2-amino-1-methyl-2-oxo-ethyl]-[[5-(piperidin-1-ium-1-ylmethyl)-2-thienyl]methyl]ammonium CAS Name: [(2S)-1-amino-1-oxopropan-2-yl]-[[5-(1-piperidin-1-iumylmethyl)-2-thiophenyl]methyl]ammonium IUPAC Name: [(2S)-1-amino-1-oxopropan-2-yl]-[[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]methyl]azanium Traditional Name: [(1S)-2-amino-2-keto-1-methyl-ethyl]-[[5-(piperidin-1-ium-1-ylmethyl)-2-thienyl]methyl]ammonium Formula: C14H25N3OS+2 MolecularWeight: 283.4328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)[NH2+]CC1=CC=C(S1)C[NH+]2CCCCC2

Isomeric SMILES

C[C@@H](C(=O)N)[NH2+]CC1=CC=C(S1)C[NH+]2CCCCC2

InChI

InChI=1S/C14H23N3OS/c1-11(14(15)18)16-9-12-5-6-13(19-12)10-17-7-3-2-4-8-17/h5-6,11,16H,2-4,7-10H2,1H3,(H2,15,18)/p+2/t11-/m0/s1