5-chloranyl-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-2-(1-pyrrolidinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-2-pyrrolidin-1-ylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[4-(methylsulfamoylmethyl)benzyl]-2-pyrrolidino-pyrimidine-4-carboxamide Formula: C18H22ClN5O3S MolecularWeight: 423.91698

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)C2=NC(=NC=C2Cl)N3CCCC3

Isomeric SMILES

CNS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)C2=NC(=NC=C2Cl)N3CCCC3

InChI

InChI=1S/C18H22ClN5O3S/c1-20-28(26,27)12-14-6-4-13(5-7-14)10-21-17(25)16-15(19)11-22-18(23-16)24-8-2-3-9-24/h4-7,11,20H,2-3,8-10,12H2,1H3,(H,21,25)