4-methylbenzenesulfonic acid; 1,4,5,6-tetrahydropyrimidin-2-amine

Systemtic Name: 4-methylbenzenesulfonic acid; 1,4,5,6-tetrahydropyrimidin-2-amine Openeye Name: 4-methylbenzenesulfonic acid; 1,4,5,6-tetrahydropyrimidin-2-amine CAS Name: 4-methylbenzenesulfonic acid; 1,4,5,6-tetrahydropyrimidin-2-amine IUPAC Name: 4-methylbenzenesulfonic acid; 1,4,5,6-tetrahydropyrimidin-2-amine Traditional Name: 1,4,5,6-tetrahydropyrimidin-2-ylamine; tosylic acid Formula: C11H17N3O3S MolecularWeight: 271.33598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CNC(=NC1)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CNC(=NC1)N

InChI

InChI=1S/C7H8O3S.C4H9N3/c1-6-2-4-7(5-3-6)11(8,9)10;5-4-6-2-1-3-7-4/h2-5H,1H3,(H,8,9,10);1-3H2,(H3,5,6,7)