dimethyl-[3-[5-(1H-pyrazol-5-yl)thiophen-2-yl]prop-2-ynyl]azanium

Systemtic Name: dimethyl-[3-[5-(1H-pyrazol-5-yl)thiophen-2-yl]prop-2-ynyl]azanium Openeye Name: dimethyl-[3-[5-(1H-pyrazol-5-yl)-2-thienyl]prop-2-ynyl]ammonium CAS Name: dimethyl-[3-[5-(1H-pyrazol-5-yl)-2-thiophenyl]prop-2-ynyl]ammonium IUPAC Name: dimethyl-[3-[5-(1H-pyrazol-5-yl)thiophen-2-yl]prop-2-ynyl]azanium Traditional Name: dimethyl-[3-[5-(1H-pyrazol-5-yl)-2-thienyl]prop-2-ynyl]ammonium Formula: C12H14N3S+ MolecularWeight: 232.32466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC#CC1=CC=C(S1)C2=CC=NN2

Isomeric SMILES

C[NH+](C)CC#CC1=CC=C(S1)C2=CC=NN2

InChI

InChI=1S/C12H13N3S/c1-15(2)9-3-4-10-5-6-12(16-10)11-7-8-13-14-11/h5-8H,9H2,1-2H3,(H,13,14)/p+1