3-ethyl-1-(1,2-oxazol-5-yl)-2-(3-oxidanylpropyl)-1-[3-(phenylcarbonyl)phenyl]guanidine

Systemtic Name: 3-ethyl-1-(1,2-oxazol-5-yl)-2-(3-oxidanylpropyl)-1-[3-(phenylcarbonyl)phenyl]guanidine Openeye Name: 1-(3-benzoylphenyl)-3-ethyl-2-(3-hydroxypropyl)-1-isoxazol-5-yl-guanidine CAS Name: 1-(3-benzoylphenyl)-3-ethyl-2-(3-hydroxypropyl)-1-(5-isoxazolyl)guanidine IUPAC Name: 1-(3-benzoylphenyl)-3-ethyl-2-(3-hydroxypropyl)-1-(1,2-oxazol-5-yl)guanidine Traditional Name: 1-(3-benzoylphenyl)-3-ethyl-2-(3-hydroxypropyl)-1-isoxazol-5-yl-guanidine Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3/c1-2-23-22(24-13-7-15-27)26(20-12-14-25-29-20)19-11-6-10-18(16-19)21(28)17-8-4-3-5-9-17/h3-6,8-12,14,16,27H,2,7,13,15H2,1H3,(H,23,24)