[2-[(2S)-2-azaniumylpropyl]-1,3-thiazol-4-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[(2S)-2-azaniumylpropyl]-1,3-thiazol-4-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: [2-[(2S)-2-azaniumylpropyl]thiazol-4-yl]methyl-benzyl-methyl-ammonium CAS Name: [2-[(2S)-2-ammoniopropyl]-4-thiazolyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: [2-[(2S)-2-azaniumylpropyl]-1,3-thiazol-4-yl]methyl-benzyl-methylazanium Traditional Name: [2-[(2S)-2-ammoniopropyl]thiazol-4-yl]methyl-benzyl-methyl-ammonium Formula: C15H23N3S+2 MolecularWeight: 277.42822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC(=CS1)C[NH+](C)CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

C[C@@H](CC1=NC(=CS1)C[NH+](C)CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C15H21N3S/c1-12(16)8-15-17-14(11-19-15)10-18(2)9-13-6-4-3-5-7-13/h3-7,11-12H,8-10,16H2,1-2H3/p+2/t12-/m0/s1