3-imidazol-1-ylpropyl-[(5-methylfuran-2-yl)methyl]-[(2-methylsulfanylpyrimidin-5-yl)methyl]azanium

Systemtic Name: 3-imidazol-1-ylpropyl-[(5-methylfuran-2-yl)methyl]-[(2-methylsulfanylpyrimidin-5-yl)methyl]azanium Openeye Name: 3-imidazol-1-ylpropyl-[(5-methyl-2-furyl)methyl]-[(2-methylsulfanylpyrimidin-5-yl)methyl]ammonium CAS Name: 3-(1-imidazolyl)propyl-[(5-methyl-2-furanyl)methyl]-[[2-(methylthio)-5-pyrimidinyl]methyl]ammonium IUPAC Name: 3-imidazol-1-ylpropyl-[(5-methylfuran-2-yl)methyl]-[(2-methylsulfanylpyrimidin-5-yl)methyl]azanium Traditional Name: 3-imidazol-1-ylpropyl-[(5-methyl-2-furyl)methyl]-[[2-(methylthio)pyrimidin-5-yl]methyl]ammonium Formula: C18H24N5OS+ MolecularWeight: 358.48106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5OS/c1-15-4-5-17(24-15)13-23(8-3-7-22-9-6-19-14-22)12-16-10-20-18(25-2)21-11-16/h4-6,9-11,14H,3,7-8,12-13H2,1-2H3/p+1