(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]prop-2-enamide Openeye Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]prop-2-enamide CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-[4-(2-pyrimidylsulfamoyl)phenyl]acrylamide Formula: C21H23ClN6O3S MolecularWeight: 474.96372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)Cl

InChI

InChI=1S/C21H23ClN6O3S/c1-3-4-14-28-20(22)18(15(2)26-28)10-11-19(29)25-16-6-8-17(9-7-16)32(30,31)27-21-23-12-5-13-24-21/h5-13H,3-4,14H2,1-2H3,(H,25,29)(H,23,24,27)/b11-10+