1-(acridin-9-ylamino)-1-[3-fluoranyl-5-(hydroxymethyl)phenyl]-3-phenyl-urea

Systemtic Name: 1-(acridin-9-ylamino)-1-[3-fluoranyl-5-(hydroxymethyl)phenyl]-3-phenyl-urea Openeye Name: 1-(acridin-9-ylamino)-1-[3-fluoro-5-(hydroxymethyl)phenyl]-3-phenyl-urea CAS Name: 1-(9-acridinylamino)-1-[3-fluoro-5-(hydroxymethyl)phenyl]-3-phenylurea IUPAC Name: 1-(acridin-9-ylamino)-1-[3-fluoro-5-(hydroxymethyl)phenyl]-3-phenylurea Traditional Name: 1-(acridin-9-ylamino)-1-(3-fluoro-5-methylol-phenyl)-3-phenyl-urea Formula: C27H21FN4O2 MolecularWeight: 452.479643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)N(C2=CC(=CC(=C2)CO)F)NC3=C4C=CC=CC4=NC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)N(C2=CC(=CC(=C2)CO)F)NC3=C4C=CC=CC4=NC5=CC=CC=C53

InChI

InChI=1S/C27H21FN4O2/c28-19-14-18(17-33)15-21(16-19)32(27(34)29-20-8-2-1-3-9-20)31-26-22-10-4-6-12-24(22)30-25-13-7-5-11-23(25)26/h1-16,33H,17H2,(H,29,34)(H,30,31)