5-chloranyl-N-[3-(methylsulfonylamino)phenyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[3-(methylsulfonylamino)phenyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[3-(methanesulfonamido)phenyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[3-(methanesulfonamido)phenyl]-2-(1-pyrrolidinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[3-(methanesulfonamido)phenyl]-2-pyrrolidin-1-ylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[3-(methanesulfonamido)phenyl]-2-pyrrolidino-pyrimidine-4-carboxamide Formula: C16H18ClN5O3S MolecularWeight: 395.86382

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)NC(=O)C2=NC(=NC=C2Cl)N3CCCC3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)NC(=O)C2=NC(=NC=C2Cl)N3CCCC3

InChI

InChI=1S/C16H18ClN5O3S/c1-26(24,25)21-12-6-4-5-11(9-12)19-15(23)14-13(17)10-18-16(20-14)22-7-2-3-8-22/h4-6,9-10,21H,2-3,7-8H2,1H3,(H,19,23)