N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]anilino]-sulfanylidenemethyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiocarbamoyl]-1-methyl-pyrazole-3-carboxamide Formula: C17H17N7O4S2 MolecularWeight: 447.49138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC=N3)OC

Isomeric SMILES

CN1C=CC(=N1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC=N3)OC

InChI

InChI=1S/C17H17N7O4S2/c1-24-8-7-13(22-24)16(25)21-17(29)20-11-3-5-12(6-4-11)30(26,27)23-14-9-15(28-2)19-10-18-14/h3-10H,1-2H3,(H,18,19,23)(H2,20,21,25,29)