2-[(5-azanyl-2-fluoranyl-phenyl)amino]-4-[(2-sulfamoylphenyl)amino]pyrimidine-5-carboxamide

Systemtic Name: 2-[(5-azanyl-2-fluoranyl-phenyl)amino]-4-[(2-sulfamoylphenyl)amino]pyrimidine-5-carboxamide Openeye Name: 2-(5-amino-2-fluoro-anilino)-4-(2-sulfamoylanilino)pyrimidine-5-carboxamide CAS Name: 2-(5-amino-2-fluoroanilino)-4-(2-sulfamoylanilino)-5-pyrimidinecarboxamide IUPAC Name: 2-(5-amino-2-fluoroanilino)-4-(2-sulfamoylanilino)pyrimidine-5-carboxamide Traditional Name: 2-(5-amino-2-fluoro-anilino)-4-(2-sulfamoylanilino)pyrimidine-5-carboxamide Formula: C17H16FN7O3S MolecularWeight: 417.417443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=NC(=NC=C2C(=O)N)NC3=C(C=CC(=C3)N)F)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)NC2=NC(=NC=C2C(=O)N)NC3=C(C=CC(=C3)N)F)S(=O)(=O)N

InChI

InChI=1S/C17H16FN7O3S/c18-11-6-5-9(19)7-13(11)24-17-22-8-10(15(20)26)16(25-17)23-12-3-1-2-4-14(12)29(21,27)28/h1-8H,19H2,(H2,20,26)(H2,21,27,28)(H2,22,23,24,25)