3,6-bis-(4-methylphenyl)sulfonylpyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 3,6-bis-(4-methylphenyl)sulfonylpyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 3,6-bis(p-tolylsulfonyl)pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 3,6-bis-(4-methylphenyl)sulfonyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 3,6-bis-(4-methylphenyl)sulfonylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (3,6-ditosylpyrazolo[1,5-a]pyrimidin-7-yl)amine Formula: C20H18N4O4S2 MolecularWeight: 442.51132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N3C(=C(C=N3)S(=O)(=O)C4=CC=C(C=C4)C)N=C2)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N3C(=C(C=N3)S(=O)(=O)C4=CC=C(C=C4)C)N=C2)N

InChI

InChI=1S/C20H18N4O4S2/c1-13-3-7-15(8-4-13)29(25,26)17-11-22-20-18(12-23-24(20)19(17)21)30(27,28)16-9-5-14(2)6-10-16/h3-12H,21H2,1-2H3