dimethyl-[3-[3-[3-(2-methylsulfanylpyrimidin-4-yl)phenyl]pyrazol-1-yl]propyl]azanium

Systemtic Name: dimethyl-[3-[3-[3-(2-methylsulfanylpyrimidin-4-yl)phenyl]pyrazol-1-yl]propyl]azanium Openeye Name: dimethyl-[3-[3-[3-(2-methylsulfanylpyrimidin-4-yl)phenyl]pyrazol-1-yl]propyl]ammonium CAS Name: dimethyl-[3-[3-[3-[2-(methylthio)-4-pyrimidinyl]phenyl]-1-pyrazolyl]propyl]ammonium IUPAC Name: dimethyl-[3-[3-[3-(2-methylsulfanylpyrimidin-4-yl)phenyl]pyrazol-1-yl]propyl]azanium Traditional Name: dimethyl-[3-[3-[3-[2-(methylthio)pyrimidin-4-yl]phenyl]pyrazol-1-yl]propyl]ammonium Formula: C19H24N5S+ MolecularWeight: 354.49236

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C=CC(=N1)C2=CC=CC(=C2)C3=NC(=NC=C3)SC

Isomeric SMILES

C[NH+](C)CCCN1C=CC(=N1)C2=CC=CC(=C2)C3=NC(=NC=C3)SC

InChI

InChI=1S/C19H23N5S/c1-23(2)11-5-12-24-13-9-18(22-24)16-7-4-6-15(14-16)17-8-10-20-19(21-17)25-3/h4,6-10,13-14H,5,11-12H2,1-3H3/p+1