(2S,4R)-N,N-dimethyl-1-[(E)-2-methylbut-2-enyl]-4-pyridin-2-ylsulfanyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-N,N-dimethyl-1-[(E)-2-methylbut-2-enyl]-4-pyridin-2-ylsulfanyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-N,N-dimethyl-1-[(E)-2-methylbut-2-enyl]-4-(2-pyridylsulfanyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-N,N-dimethyl-1-[(E)-2-methylbut-2-enyl]-4-(2-pyridinylthio)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-N,N-dimethyl-1-[(E)-2-methylbut-2-enyl]-4-pyridin-2-ylsulfanylpyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-N,N-dimethyl-1-[(E)-2-methylbut-2-enyl]-4-(2-pyridylthio)pyrrolidin-1-ium-2-carboxamide Formula: C17H26N3OS+ MolecularWeight: 320.47284

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C[NH+]1CC(CC1C(=O)N(C)C)SC2=CC=CC=N2

Isomeric SMILES

C/C=C(\C)/C[NH+]1C[C@@H](C[C@H]1C(=O)N(C)C)SC2=CC=CC=N2

InChI

InChI=1S/C17H25N3OS/c1-5-13(2)11-20-12-14(10-15(20)17(21)19(3)4)22-16-8-6-7-9-18-16/h5-9,14-15H,10-12H2,1-4H3/p+1/b13-5+/t14-,15+/m1/s1