3-imidazol-1-ylpropyl-[(5-methylfuran-2-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium

Systemtic Name: 3-imidazol-1-ylpropyl-[(5-methylfuran-2-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium Openeye Name: 3-imidazol-1-ylpropyl-[(5-methyl-2-furyl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]ammonium CAS Name: 3-(1-imidazolyl)propyl-[(5-methyl-2-furanyl)methyl]-[[4-(1-pyrazolyl)phenyl]methyl]ammonium IUPAC Name: 3-imidazol-1-ylpropyl-[(5-methylfuran-2-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium Traditional Name: 3-imidazol-1-ylpropyl-[(5-methyl-2-furyl)methyl]-(4-pyrazol-1-ylbenzyl)ammonium Formula: C22H26N5O+ MolecularWeight: 376.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+](CCCN2C=CN=C2)CC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC1=CC=C(O1)C[NH+](CCCN2C=CN=C2)CC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C22H25N5O/c1-19-4-9-22(28-19)17-26(13-3-12-25-15-11-23-18-25)16-20-5-7-21(8-6-20)27-14-2-10-24-27/h2,4-11,14-15,18H,3,12-13,16-17H2,1H3/p+1