N-[1-(2-fluorophenyl)-2-oxidanyl-ethyl]-2-[(4-oxidanylcyclohexyl)amino]quinazoline-7-carboxamide

Systemtic Name: N-[1-(2-fluorophenyl)-2-oxidanyl-ethyl]-2-[(4-oxidanylcyclohexyl)amino]quinazoline-7-carboxamide Openeye Name: N-[1-(2-fluorophenyl)-2-hydroxy-ethyl]-2-[(4-hydroxycyclohexyl)amino]quinazoline-7-carboxamide CAS Name: N-[1-(2-fluorophenyl)-2-hydroxyethyl]-2-[(4-hydroxycyclohexyl)amino]-7-quinazolinecarboxamide IUPAC Name: N-[1-(2-fluorophenyl)-2-hydroxyethyl]-2-[(4-hydroxycyclohexyl)amino]quinazoline-7-carboxamide Traditional Name: N-[1-(2-fluorophenyl)-2-hydroxy-ethyl]-2-[(4-hydroxycyclohexyl)amino]quinazoline-7-carboxamide Formula: C23H25FN4O3 MolecularWeight: 424.468003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC=C3C=CC(=CC3=N2)C(=O)NC(CO)C4=CC=CC=C4F)O

Isomeric SMILES

C1CC(CCC1NC2=NC=C3C=CC(=CC3=N2)C(=O)NC(CO)C4=CC=CC=C4F)O

InChI

InChI=1S/C23H25FN4O3/c24-19-4-2-1-3-18(19)21(13-29)27-22(31)14-5-6-15-12-25-23(28-20(15)11-14)26-16-7-9-17(30)10-8-16/h1-6,11-12,16-17,21,29-30H,7-10,13H2,(H,27,31)(H,25,26,28)