4-(aminocarbonylamino)-1-[3-chloranyl-4-(3-fluoranyl-4-oxidanyl-phenyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 4-(aminocarbonylamino)-1-[3-chloranyl-4-(3-fluoranyl-4-oxidanyl-phenyl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-[3-chloro-4-(3-fluoro-4-hydroxy-phenyl)phenyl]-4-ureido-pyrazole-3-carboxamide CAS Name: 4-(carbamoylamino)-1-[3-chloro-4-(3-fluoro-4-hydroxyphenyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-(carbamoylamino)-1-[3-chloro-4-(3-fluoro-4-hydroxyphenyl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-[3-chloro-4-(3-fluoro-4-hydroxy-phenyl)phenyl]-4-ureido-pyrazole-3-carboxamide Formula: C17H13ClFN5O3 MolecularWeight: 389.768223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=C(C=C(C=C2)N3C=C(C(=N3)C(=O)N)NC(=O)N)Cl)F)O

Isomeric SMILES

C1=CC(=C(C=C1C2=C(C=C(C=C2)N3C=C(C(=N3)C(=O)N)NC(=O)N)Cl)F)O

InChI

InChI=1S/C17H13ClFN5O3/c18-11-6-9(2-3-10(11)8-1-4-14(25)12(19)5-8)24-7-13(22-17(21)27)15(23-24)16(20)26/h1-7,25H,(H2,20,26)(H3,21,22,27)