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

Systemtic Name: 3-ethyl-1-(3-fluoranyl-4-phenyl-phenyl)-1-(1,2-oxazol-5-yl)-2-(2-pyrrolidin-1-ylethyl)guanidine Openeye Name: 3-ethyl-1-(3-fluoro-4-phenyl-phenyl)-1-isoxazol-5-yl-2-(2-pyrrolidin-1-ylethyl)guanidine CAS Name: 3-ethyl-1-(3-fluoro-4-phenylphenyl)-1-(5-isoxazolyl)-2-[2-(1-pyrrolidinyl)ethyl]guanidine IUPAC Name: 3-ethyl-1-(3-fluoro-4-phenylphenyl)-1-(1,2-oxazol-5-yl)-2-(2-pyrrolidin-1-ylethyl)guanidine Traditional Name: 3-ethyl-1-(3-fluoro-4-phenyl-phenyl)-1-isoxazol-5-yl-2-(2-pyrrolidinoethyl)guanidine Formula: C24H28FN5O MolecularWeight: 421.510423

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=NCCN1CCCC1)N(C2=CC(=C(C=C2)C3=CC=CC=C3)F)C4=CC=NO4

Isomeric SMILES

CCNC(=NCCN1CCCC1)N(C2=CC(=C(C=C2)C3=CC=CC=C3)F)C4=CC=NO4

InChI

InChI=1S/C24H28FN5O/c1-2-26-24(27-14-17-29-15-6-7-16-29)30(23-12-13-28-31-23)20-10-11-21(22(25)18-20)19-8-4-3-5-9-19/h3-5,8-13,18H,2,6-7,14-17H2,1H3,(H,26,27)