4-azanyl-N-pyrimidin-2-yl-benzenesulfonamide; 2-(phosphonomethylamino)ethanoic acid

Systemtic Name: 4-azanyl-N-pyrimidin-2-yl-benzenesulfonamide; 2-(phosphonomethylamino)ethanoic acid Openeye Name: 4-amino-N-pyrimidin-2-yl-benzenesulfonamide; 2-(phosphonomethylamino)acetic acid CAS Name: 4-amino-N-(2-pyrimidinyl)benzenesulfonamide; 2-(phosphonomethylamino)acetic acid IUPAC Name: 4-amino-N-pyrimidin-2-ylbenzenesulfonamide; 2-(phosphonomethylamino)acetic acid Traditional Name: 4-amino-N-(2-pyrimidyl)benzenesulfonamide; 2-(phosphonomethylamino)acetic acid Formula: C13H18N5O7PS MolecularWeight: 419.350081

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N.C(C(=O)O)NCP(=O)(O)O

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N.C(C(=O)O)NCP(=O)(O)O

InChI

InChI=1S/C10H10N4O2S.C3H8NO5P/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10;5-3(6)1-4-2-10(7,8)9/h1-7H,11H2,(H,12,13,14);4H,1-2H2,(H,5,6)(H2,7,8,9)