(1S,2S)-1-azanyl-2-[[[azanyl-[(4-methylphenyl)sulfonylamino]methylidene]amino]methyl]cyclopropane-1-carboxylic acid

Systemtic Name: (1S,2S)-1-azanyl-2-[[[azanyl-[(4-methylphenyl)sulfonylamino]methylidene]amino]methyl]cyclopropane-1-carboxylic acid Openeye Name: (1S,2S)-1-amino-2-[[[amino-(p-tolylsulfonylamino)methylene]amino]methyl]cyclopropanecarboxylic acid CAS Name: (1S,2S)-1-amino-2-[[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]methyl]-1-cyclopropanecarboxylic acid IUPAC Name: (1S,2S)-1-amino-2-[[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]methyl]cyclopropane-1-carboxylic acid Traditional Name: (1S,2S)-1-amino-2-[[[amino-(tosylamino)methylene]amino]methyl]cyclopropanecarboxylic acid Formula: C13H18N4O4S MolecularWeight: 326.37142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCC2CC2(C(=O)O)N)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=NC[C@@H]2C[C@]2(C(=O)O)N)N

InChI

InChI=1S/C13H18N4O4S/c1-8-2-4-10(5-3-8)22(20,21)17-12(14)16-7-9-6-13(9,15)11(18)19/h2-5,9H,6-7,15H2,1H3,(H,18,19)(H3,14,16,17)/t9-,13-/m0/s1