1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C18H21N7O2S2 MolecularWeight: 431.53504

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)C

Isomeric SMILES

CCN1C(=C(C=N1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)C

InChI

InChI=1S/C18H21N7O2S2/c1-3-25-13(2)14(12-22-25)11-21-18(28)23-15-5-7-16(8-6-15)29(26,27)24-17-19-9-4-10-20-17/h4-10,12H,3,11H2,1-2H3,(H,19,20,24)(H2,21,23,28)