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

Systemtic Name: 4-(aminocarbonylamino)-1-[3-fluoranyl-4-(3-methyl-4-oxidanyl-phenyl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-[3-fluoro-4-(4-hydroxy-3-methyl-phenyl)phenyl]-4-ureido-pyrazole-3-carboxamide CAS Name: 4-(carbamoylamino)-1-[3-fluoro-4-(4-hydroxy-3-methylphenyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-(carbamoylamino)-1-[3-fluoro-4-(4-hydroxy-3-methylphenyl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-[3-fluoro-4-(4-hydroxy-3-methyl-phenyl)phenyl]-4-ureido-pyrazole-3-carboxamide Formula: C18H16FN5O3 MolecularWeight: 369.349743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C(C=C(C=C2)N3C=C(C(=N3)C(=O)N)NC(=O)N)F)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2=C(C=C(C=C2)N3C=C(C(=N3)C(=O)N)NC(=O)N)F)O

InChI

InChI=1S/C18H16FN5O3/c1-9-6-10(2-5-15(9)25)12-4-3-11(7-13(12)19)24-8-14(22-18(21)27)16(23-24)17(20)26/h2-8,25H,1H3,(H2,20,26)(H3,21,22,27)