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

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C19H19N5O4S2 MolecularWeight: 445.51526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)OC

InChI

InChI=1S/C19H19N5O4S2/c1-27-16-9-6-14(12-17(16)28-2)23-19(29)22-13-4-7-15(8-5-13)30(25,26)24-18-20-10-3-11-21-18/h3-12H,1-2H3,(H,20,21,24)(H2,22,23,29)