4-(6-azanylpyrimidin-4-yl)-N-[(1R)-1-(4-chloranyl-3-fluoranyl-phenyl)-2-oxidanyl-ethyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-(6-azanylpyrimidin-4-yl)-N-[(1R)-1-(4-chloranyl-3-fluoranyl-phenyl)-2-oxidanyl-ethyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-(6-aminopyrimidin-4-yl)-N-[(1R)-1-(4-chloro-3-fluoro-phenyl)-2-hydroxy-ethyl]-1H-pyrrole-2-carboxamide CAS Name: 4-(6-amino-4-pyrimidinyl)-N-[(1R)-1-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-(6-aminopyrimidin-4-yl)-N-[(1R)-1-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-(6-aminopyrimidin-4-yl)-N-[(1R)-1-(4-chloro-3-fluoro-phenyl)-2-hydroxy-ethyl]-1H-pyrrole-2-carboxamide Formula: C17H15ClFN5O2 MolecularWeight: 375.784703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(CO)NC(=O)C2=CC(=CN2)C3=CC(=NC=N3)N)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1[C@H](CO)NC(=O)C2=CC(=CN2)C3=CC(=NC=N3)N)F)Cl

InChI

InChI=1S/C17H15ClFN5O2/c18-11-2-1-9(3-12(11)19)15(7-25)24-17(26)14-4-10(6-21-14)13-5-16(20)23-8-22-13/h1-6,8,15,21,25H,7H2,(H,24,26)(H2,20,22,23)/t15-/m0/s1