3-ethyl-1-(3-fluoranyl-4-phenyl-phenyl)-1-(1,2-oxazol-5-yl)-2-(3-oxidanylpropyl)guanidine

Systemtic Name: 3-ethyl-1-(3-fluoranyl-4-phenyl-phenyl)-1-(1,2-oxazol-5-yl)-2-(3-oxidanylpropyl)guanidine Openeye Name: 3-ethyl-1-(3-fluoro-4-phenyl-phenyl)-2-(3-hydroxypropyl)-1-isoxazol-5-yl-guanidine CAS Name: 3-ethyl-1-(3-fluoro-4-phenylphenyl)-2-(3-hydroxypropyl)-1-(5-isoxazolyl)guanidine IUPAC Name: 3-ethyl-1-(3-fluoro-4-phenylphenyl)-2-(3-hydroxypropyl)-1-(1,2-oxazol-5-yl)guanidine Traditional Name: 3-ethyl-1-(3-fluoro-4-phenyl-phenyl)-2-(3-hydroxypropyl)-1-isoxazol-5-yl-guanidine Formula: C21H23FN4O2 MolecularWeight: 382.431323

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=NCCCO)N(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C3=CC=NO3

Isomeric SMILES

CCNC(=NCCCO)N(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C3=CC=NO3

InChI

InChI=1S/C21H23FN4O2/c1-2-23-21(24-12-6-14-27)26(20-11-13-25-28-20)17-9-10-18(19(22)15-17)16-7-4-3-5-8-16/h3-5,7-11,13,15,27H,2,6,12,14H2,1H3,(H,23,24)