1-(4-ethoxy-2-nitro-phenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-(4-ethoxy-2-nitro-phenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-(4-ethoxy-2-nitro-phenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-(4-ethoxy-2-nitrophenyl)-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(4-ethoxy-2-nitrophenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(4-ethoxy-2-nitro-phenyl)-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C19H18N6O5S2 MolecularWeight: 474.51342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N6O5S2/c1-2-30-14-6-9-16(17(12-14)25(26)27)23-19(31)22-13-4-7-15(8-5-13)32(28,29)24-18-20-10-3-11-21-18/h3-12H,2H2,1H3,(H,20,21,24)(H2,22,23,31)