1-[3-(5-methylpyrazol-1-yl)propyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1CCCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

Isomeric SMILES

CC1=CC=NN1CCCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

InChI

InChI=1S/C18H21N7O2S2/c1-14-8-12-22-25(14)13-3-11-21-18(28)23-15-4-6-16(7-5-15)29(26,27)24-17-19-9-2-10-20-17/h2,4-10,12H,3,11,13H2,1H3,(H,19,20,24)(H2,21,23,28)