dimethyl-[[4-[[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[[[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]amino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[[[oxo-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[(1-phenyl-3-thiophen-2-ylpyrazole-4-carbonyl)amino]methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[[[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]amino]methyl]benzyl]ammonium Formula: C24H25N4OS+ MolecularWeight: 417.5465

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4OS/c1-27(2)16-19-12-10-18(11-13-19)15-25-24(29)21-17-28(20-7-4-3-5-8-20)26-23(21)22-9-6-14-30-22/h3-14,17H,15-16H2,1-2H3,(H,25,29)/p+1