2-azanyl-5-[[azanyl-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoic acid

Systemtic Name: 2-azanyl-5-[[azanyl-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoic acid Openeye Name: 2-amino-5-[[amino-(p-tolylsulfonylamino)methylene]amino]pentanoic acid CAS Name: 2-amino-5-[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoic acid IUPAC Name: 2-amino-5-[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoic acid Traditional Name: 2-amino-5-[[amino-(tosylamino)methylene]amino]valeric acid Formula: C13H20N4O4S MolecularWeight: 328.3873

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N4O4S/c1-9-4-6-10(7-5-9)22(20,21)17-13(15)16-8-2-3-11(14)12(18)19/h4-7,11H,2-3,8,14H2,1H3,(H,18,19)(H3,15,16,17)