methyl-[[3-(5-methylthiophen-2-yl)-1H-pyrazol-5-yl]methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: methyl-[[3-(5-methylthiophen-2-yl)-1H-pyrazol-5-yl]methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: methyl-[[3-(5-methyl-2-thienyl)-1H-pyrazol-5-yl]methyl]-(3-pyridylmethyl)ammonium CAS Name: methyl-[[3-(5-methyl-2-thiophenyl)-1H-pyrazol-5-yl]methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: methyl-[[3-(5-methylthiophen-2-yl)-1H-pyrazol-5-yl]methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: methyl-[[3-(5-methyl-2-thienyl)-1H-pyrazol-5-yl]methyl]-(3-pyridylmethyl)ammonium Formula: C16H19N4S+ MolecularWeight: 299.41386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NNC(=C2)C[NH+](C)CC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(S1)C2=NNC(=C2)C[NH+](C)CC3=CN=CC=C3

InChI

InChI=1S/C16H18N4S/c1-12-5-6-16(21-12)15-8-14(18-19-15)11-20(2)10-13-4-3-7-17-9-13/h3-9H,10-11H2,1-2H3,(H,18,19)/p+1