3-methyl-1-phenyl-N-[(1S,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 3-methyl-1-phenyl-N-[(1S,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 3-methyl-N-[(1S,2S)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 3-methyl-1-phenyl-N-[(1S,2S)-1-(1-pyrrolidin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 3-methyl-1-phenyl-N-[(1S,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-ylpropan-2-yl]thieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 3-methyl-N-[(1S,2S)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C24H27N4OS2+ MolecularWeight: 451.62738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC(C)C(C3=CC=CS3)[NH+]4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)N[C@@H](C)[C@@H](C3=CC=CS3)[NH+]4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C24H26N4OS2/c1-16-19-15-21(31-24(19)28(26-16)18-9-4-3-5-10-18)23(29)25-17(2)22(20-11-8-14-30-20)27-12-6-7-13-27/h3-5,8-11,14-15,17,22H,6-7,12-13H2,1-2H3,(H,25,29)/p+1/t17-,22-/m0/s1