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

Systemtic Name: 1-ethyl-3-methyl-2-(1,2-oxazol-5-yl)-3-[3-(phenylcarbonyl)phenyl]-1-(2-piperidin-1-ylethyl)guanidine Openeye Name: 1-(3-benzoylphenyl)-3-ethyl-2-isoxazol-5-yl-1-methyl-3-[2-(1-piperidyl)ethyl]guanidine CAS Name: 1-(3-benzoylphenyl)-3-ethyl-2-(5-isoxazolyl)-1-methyl-3-[2-(1-piperidinyl)ethyl]guanidine IUPAC Name: 1-(3-benzoylphenyl)-3-ethyl-1-methyl-2-(1,2-oxazol-5-yl)-3-(2-piperidin-1-ylethyl)guanidine Traditional Name: 1-(3-benzoylphenyl)-3-ethyl-2-isoxazol-5-yl-1-methyl-3-(2-piperidinoethyl)guanidine Formula: C27H33N5O2 MolecularWeight: 459.58322

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCN1CCCCC1)C(=NC2=CC=NO2)N(C)C3=CC=CC(=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCN(CCN1CCCCC1)/C(=N/C2=CC=NO2)/N(C)C3=CC=CC(=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H33N5O2/c1-3-32(20-19-31-17-8-5-9-18-31)27(29-25-15-16-28-34-25)30(2)24-14-10-13-23(21-24)26(33)22-11-6-4-7-12-22/h4,6-7,10-16,21H,3,5,8-9,17-20H2,1-2H3/b29-27+