6-[2,6-bis(methylsulfonyl)phenyl]-1,4,5,6-tetrahydropyrimidin-2-amine

Systemtic Name: 6-[2,6-bis(methylsulfonyl)phenyl]-1,4,5,6-tetrahydropyrimidin-2-amine Openeye Name: 6-[2,6-bis(methylsulfonyl)phenyl]-1,4,5,6-tetrahydropyrimidin-2-amine CAS Name: 6-[2,6-bis(methylsulfonyl)phenyl]-1,4,5,6-tetrahydropyrimidin-2-amine IUPAC Name: 6-[2,6-bis(methylsulfonyl)phenyl]-1,4,5,6-tetrahydropyrimidin-2-amine Traditional Name: [6-(2,6-dimesylphenyl)-1,4,5,6-tetrahydropyrimidin-2-yl]amine Formula: C12H17N3O4S2 MolecularWeight: 331.41108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=CC=C1)S(=O)(=O)C)C2CCN=C(N2)N

Isomeric SMILES

CS(=O)(=O)C1=C(C(=CC=C1)S(=O)(=O)C)C2CCN=C(N2)N

InChI

InChI=1S/C12H17N3O4S2/c1-20(16,17)9-4-3-5-10(21(2,18)19)11(9)8-6-7-14-12(13)15-8/h3-5,8H,6-7H2,1-2H3,(H3,13,14,15)