[2-oxidanylidene-2-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]ethyl] morpholine-4-carbodithioate

Systemtic Name: [2-oxidanylidene-2-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]ethyl] morpholine-4-carbodithioate Openeye Name: [2-oxo-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]ethyl] morpholine-4-carbodithioate CAS Name: 4-morpholinecarbodithioic acid [2-oxo-2-[4-(2-pyrimidinylsulfamoyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]ethyl] morpholine-4-carbodithioate Traditional Name: morpholine-4-carbodithioic acid [2-keto-2-[4-(2-pyrimidylsulfamoyl)anilino]ethyl] ester Formula: C17H19N5O4S3 MolecularWeight: 453.55886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

Isomeric SMILES

C1COCCN1C(=S)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

InChI

InChI=1S/C17H19N5O4S3/c23-15(12-28-17(27)22-8-10-26-11-9-22)20-13-2-4-14(5-3-13)29(24,25)21-16-18-6-1-7-19-16/h1-7H,8-12H2,(H,20,23)(H,18,19,21)