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

Systemtic Name: 5-chloranyl-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[4-(2-furylmethylcarbamoylamino)phenyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-[[(2-furanylmethylamino)-oxomethyl]amino]phenyl]-2-(1-pyrrolidinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-pyrrolidin-1-ylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[4-(2-furfurylcarbamoylamino)phenyl]-2-pyrrolidino-pyrimidine-4-carboxamide Formula: C21H21ClN6O3 MolecularWeight: 440.88284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)NC(=O)NCC4=CC=CO4)Cl

Isomeric SMILES

C1CCN(C1)C2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)NC(=O)NCC4=CC=CO4)Cl

InChI

InChI=1S/C21H21ClN6O3/c22-17-13-23-20(28-9-1-2-10-28)27-18(17)19(29)25-14-5-7-15(8-6-14)26-21(30)24-12-16-4-3-11-31-16/h3-8,11,13H,1-2,9-10,12H2,(H,25,29)(H2,24,26,30)