3-butoxy-N-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]thiocarbamoyl]benzamide Formula: C24H27N5O6S2 MolecularWeight: 545.63108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC(=N3)OC)OC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC(=N3)OC)OC

InChI

InChI=1S/C24H27N5O6S2/c1-4-5-13-35-18-8-6-7-16(14-18)22(30)28-24(36)25-17-9-11-19(12-10-17)37(31,32)29-20-15-21(33-2)27-23(26-20)34-3/h6-12,14-15H,4-5,13H2,1-3H3,(H,26,27,29)(H2,25,28,30,36)