2-azanyl-2-[(5S)-5-(phenylmethyl)-4,5-dihydro-1H-imidazol-2-yl]ethanesulfonic acid

Systemtic Name: 2-azanyl-2-[(5S)-5-(phenylmethyl)-4,5-dihydro-1H-imidazol-2-yl]ethanesulfonic acid Openeye Name: 2-amino-2-[(5S)-5-benzyl-4,5-dihydro-1H-imidazol-2-yl]ethanesulfonic acid CAS Name: 2-amino-2-[(5S)-5-(phenylmethyl)-4,5-dihydro-1H-imidazol-2-yl]ethanesulfonic acid IUPAC Name: 2-amino-2-[(5S)-5-benzyl-4,5-dihydro-1H-imidazol-2-yl]ethanesulfonic acid Traditional Name: 2-amino-2-[(4S)-4-benzyl-2-imidazolin-2-yl]ethanesulfonic acid Formula: C12H17N3O3S MolecularWeight: 283.34668

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=N1)C(CS(=O)(=O)O)N)CC2=CC=CC=C2

Isomeric SMILES

C1[C@@H](NC(=N1)C(CS(=O)(=O)O)N)CC2=CC=CC=C2

InChI

InChI=1S/C12H17N3O3S/c13-11(8-19(16,17)18)12-14-7-10(15-12)6-9-4-2-1-3-5-9/h1-5,10-11H,6-8,13H2,(H,14,15)(H,16,17,18)/t10-,11?/m0/s1