4-methylbenzenesulfonic acid; 1-(methylsulfanylamino)urea

Systemtic Name: 4-methylbenzenesulfonic acid; 1-(methylsulfanylamino)urea Openeye Name: 4-methylbenzenesulfonic acid; (methylsulfanylamino)urea CAS Name: 4-methylbenzenesulfonic acid; [(methylthio)amino]urea IUPAC Name: 4-methylbenzenesulfonic acid; (methylsulfanylamino)urea Traditional Name: [(methylthio)amino]urea; tosylic acid Formula: C9H15N3O4S2 MolecularWeight: 293.3631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CSNNC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CSNNC(=O)N

InChI

InChI=1S/C7H8O3S.C2H7N3OS/c1-6-2-4-7(5-3-6)11(8,9)10;1-7-5-4-2(3)6/h2-5H,1H3,(H,8,9,10);5H,1H3,(H3,3,4,6)