N-methyl-5-[(2S)-1-(3-methylsulfanylpropyl)pyrrolidin-1-ium-2-yl]-N-(pyrazin-2-ylmethyl)thiophene-2-carboxamide

Systemtic Name: N-methyl-5-[(2S)-1-(3-methylsulfanylpropyl)pyrrolidin-1-ium-2-yl]-N-(pyrazin-2-ylmethyl)thiophene-2-carboxamide Openeye Name: N-methyl-5-[(2S)-1-(3-methylsulfanylpropyl)pyrrolidin-1-ium-2-yl]-N-(pyrazin-2-ylmethyl)thiophene-2-carboxamide CAS Name: N-methyl-5-[(2S)-1-[3-(methylthio)propyl]-2-pyrrolidin-1-iumyl]-N-(2-pyrazinylmethyl)-2-thiophenecarboxamide IUPAC Name: N-methyl-5-[(2S)-1-(3-methylsulfanylpropyl)pyrrolidin-1-ium-2-yl]-N-(pyrazin-2-ylmethyl)thiophene-2-carboxamide Traditional Name: N-methyl-5-[(2S)-1-[3-(methylthio)propyl]pyrrolidin-1-ium-2-yl]-N-(pyrazin-2-ylmethyl)thiophene-2-carboxamide Formula: C19H27N4OS2+ MolecularWeight: 391.57388

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC=CN=C1)C(=O)C2=CC=C(S2)C3CCC[NH+]3CCCSC

Isomeric SMILES

CN(CC1=NC=CN=C1)C(=O)C2=CC=C(S2)[C@@H]3CCC[NH+]3CCCSC

InChI

InChI=1S/C19H26N4OS2/c1-22(14-15-13-20-8-9-21-15)19(24)18-7-6-17(26-18)16-5-3-10-23(16)11-4-12-25-2/h6-9,13,16H,3-5,10-12,14H2,1-2H3/p+1/t16-/m0/s1