2-(pyrimidin-2-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide

Systemtic Name: 2-(pyrimidin-2-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Openeye Name: 2-(pyrimidin-2-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide CAS Name: 2-(2-pyrimidinyloxymethyl)-N-(4-sulfamoylphenyl)-4-morpholinecarbothioamide IUPAC Name: 2-(pyrimidin-2-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Traditional Name: 2-(2-pyrimidyloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Formula: C16H19N5O4S2 MolecularWeight: 409.48316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N)COC3=NC=CC=N3

Isomeric SMILES

C1COC(CN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N)COC3=NC=CC=N3

InChI

InChI=1S/C16H19N5O4S2/c17-27(22,23)14-4-2-12(3-5-14)20-16(26)21-8-9-24-13(10-21)11-25-15-18-6-1-7-19-15/h1-7,13H,8-11H2,(H,20,26)(H2,17,22,23)