1-azanylurea; 4-methylbenzenesulfonate

Systemtic Name: 1-azanylurea; 4-methylbenzenesulfonate Openeye Name: aminourea; 4-methylbenzenesulfonate CAS Name: aminourea; 4-methylbenzenesulfonate IUPAC Name: aminourea; 4-methylbenzenesulfonate Traditional Name: aminourea tosylate Formula: C8H12N3O4S- MolecularWeight: 246.26358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C(=O)(N)NN

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C(=O)(N)NN

InChI

InChI=1S/C7H8O3S.CH5N3O/c1-6-2-4-7(5-3-6)11(8,9)10;2-1(5)4-3/h2-5H,1H3,(H,8,9,10);3H2,(H3,2,4,5)/p-1