1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(3,4,5-trimethoxyphenyl)thiourea

Systemtic Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(3,4,5-trimethoxyphenyl)thiourea Openeye Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(3,4,5-trimethoxyphenyl)thiourea CAS Name: 1-[4-(2-pyrimidinylsulfamoyl)phenyl]-3-(3,4,5-trimethoxyphenyl)thiourea IUPAC Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(3,4,5-trimethoxyphenyl)thiourea Traditional Name: 1-[4-(2-pyrimidylsulfamoyl)phenyl]-3-(3,4,5-trimethoxyphenyl)thiourea Formula: C20H21N5O5S2 MolecularWeight: 475.54124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

InChI

InChI=1S/C20H21N5O5S2/c1-28-16-11-14(12-17(29-2)18(16)30-3)24-20(31)23-13-5-7-15(8-6-13)32(26,27)25-19-21-9-4-10-22-19/h4-12H,1-3H3,(H,21,22,25)(H2,23,24,31)