5-morpholin-4-ylsulfonyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]pyridin-2-amine

Systemtic Name: 5-morpholin-4-ylsulfonyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]pyridin-2-amine Openeye Name: 5-morpholinosulfonyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]pyridin-2-amine CAS Name: 5-(4-morpholinylsulfonyl)-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]-2-pyridinamine IUPAC Name: 5-morpholin-4-ylsulfonyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]pyridin-2-amine Traditional Name: (5-morpholinosulfonyl-2-pyridyl)-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]amine Formula: C19H27N4O3S2+ MolecularWeight: 423.57268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=CS4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C19H26N4O3S2/c24-28(25,23-9-11-26-12-10-23)16-5-6-19(20-14-16)21-15-17(18-4-3-13-27-18)22-7-1-2-8-22/h3-6,13-14,17H,1-2,7-12,15H2,(H,20,21)/p+1/t17-/m0/s1