[(2S)-1-[2-[(phenylmethyl)amino]-1,3-thiazol-4-yl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[2-[(phenylmethyl)amino]-1,3-thiazol-4-yl]propan-2-yl]azanium Openeye Name: [(1S)-2-[2-(benzylamino)thiazol-4-yl]-1-methyl-ethyl]ammonium CAS Name: [(2S)-1-[2-[(phenylmethyl)amino]-4-thiazolyl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-(benzylamino)-1,3-thiazol-4-yl]propan-2-yl]azanium Traditional Name: [(1S)-2-[2-(benzylamino)thiazol-4-yl]-1-methyl-ethyl]ammonium Formula: C13H18N3S+ MolecularWeight: 248.36712

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CSC(=N1)NCC2=CC=CC=C2)[NH3+]

Isomeric SMILES

C[C@@H](CC1=CSC(=N1)NCC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C13H17N3S/c1-10(14)7-12-9-17-13(16-12)15-8-11-5-3-2-4-6-11/h2-6,9-10H,7-8,14H2,1H3,(H,15,16)/p+1/t10-/m0/s1