N-(4-ethylphenyl)-4,6-bis(methylamino)-2-(4-sulfamoylphenyl)pyrimidine-5-carboxamide

Systemtic Name: N-(4-ethylphenyl)-4,6-bis(methylamino)-2-(4-sulfamoylphenyl)pyrimidine-5-carboxamide Openeye Name: N-(4-ethylphenyl)-4,6-bis(methylamino)-2-(4-sulfamoylphenyl)pyrimidine-5-carboxamide CAS Name: N-(4-ethylphenyl)-4,6-bis(methylamino)-2-(4-sulfamoylphenyl)-5-pyrimidinecarboxamide IUPAC Name: N-(4-ethylphenyl)-4,6-bis(methylamino)-2-(4-sulfamoylphenyl)pyrimidine-5-carboxamide Traditional Name: N-(4-ethylphenyl)-4,6-bis(methylamino)-2-(4-sulfamoylphenyl)pyrimidine-5-carboxamide Formula: C21H24N6O3S MolecularWeight: 440.51866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(N=C(N=C2NC)C3=CC=C(C=C3)S(=O)(=O)N)NC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(N=C(N=C2NC)C3=CC=C(C=C3)S(=O)(=O)N)NC

InChI

InChI=1S/C21H24N6O3S/c1-4-13-5-9-15(10-6-13)25-21(28)17-19(23-2)26-18(27-20(17)24-3)14-7-11-16(12-8-14)31(22,29)30/h5-12H,4H2,1-3H3,(H,25,28)(H2,22,29,30)(H2,23,24,26,27)