N-methyl-N-[4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioylamino]phenyl]ethanamide

Systemtic Name: N-methyl-N-[4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioylamino]phenyl]ethanamide Openeye Name: N-methyl-N-[4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioylamino]phenyl]acetamide CAS Name: N-methyl-N-[4-[[[4-(2-pyrimidinylsulfamoyl)anilino]-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-methyl-N-[4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioylamino]phenyl]acetamide Traditional Name: N-methyl-N-[4-[[4-(2-pyrimidylsulfamoyl)phenyl]thiocarbamoylamino]phenyl]acetamide Formula: C20H20N6O3S2 MolecularWeight: 456.5412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

Isomeric SMILES

CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

InChI

InChI=1S/C20H20N6O3S2/c1-14(27)26(2)17-8-4-15(5-9-17)23-20(30)24-16-6-10-18(11-7-16)31(28,29)25-19-21-12-3-13-22-19/h3-13H,1-2H3,(H,21,22,25)(H2,23,24,30)