5-[(2S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]-N-(2-pyridin-2-ylethyl)thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]-N-(2-pyridin-2-ylethyl)thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]-N-[2-(2-pyridyl)ethyl]thiophene-2-carboxamide CAS Name: 5-[(2S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-pyrrolidin-1-iumyl]-N-[2-(2-pyridinyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]-N-(2-pyridin-2-ylethyl)thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]-N-[2-(2-pyridyl)ethyl]thiophene-2-carboxamide Formula: C21H26N5OS+ MolecularWeight: 396.52904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C[NH+]2CCCC2C3=CC=C(S3)C(=O)NCCC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=NN1)C[NH+]2CCC[C@H]2C3=CC=C(S3)C(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C21H25N5OS/c1-15-13-17(25-24-15)14-26-12-4-6-18(26)19-7-8-20(28-19)21(27)23-11-9-16-5-2-3-10-22-16/h2-3,5,7-8,10,13,18H,4,6,9,11-12,14H2,1H3,(H,23,27)(H,24,25)/p+1/t18-/m0/s1