[4-ethoxycarbonyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazol-3-yl]methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [4-ethoxycarbonyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazol-3-yl]methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [4-ethoxycarbonyl-2-(4-phenylthiazol-2-yl)pyrazol-3-yl]methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [4-ethoxycarbonyl-2-(4-phenyl-2-thiazolyl)-3-pyrazolyl]methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [4-ethoxycarbonyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazol-3-yl]methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [4-carbethoxy-2-(4-phenylthiazol-2-yl)pyrazol-3-yl]methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C23H24N5O2S+ MolecularWeight: 434.53396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)C[NH2+]CCC4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)C[NH2+]CCC4=CC=CC=N4

InChI

InChI=1S/C23H23N5O2S/c1-2-30-22(29)19-14-26-28(21(19)15-24-13-11-18-10-6-7-12-25-18)23-27-20(16-31-23)17-8-4-3-5-9-17/h3-10,12,14,16,24H,2,11,13,15H2,1H3/p+1