2,3-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-1H-indole-5-carboxamide

Systemtic Name: 2,3-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-1H-indole-5-carboxamide Openeye Name: 2,3-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-1H-indole-5-carboxamide CAS Name: 2,3-dimethyl-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]-1H-indole-5-carboxamide IUPAC Name: 2,3-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]-1H-indole-5-carboxamide Traditional Name: 2,3-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-1H-indole-5-carboxamide Formula: C21H26N3OS+ MolecularWeight: 368.51564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)NCC(C3=CC=CS3)[NH+]4CCCC4)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)NC[C@@H](C3=CC=CS3)[NH+]4CCCC4)C

InChI

InChI=1S/C21H25N3OS/c1-14-15(2)23-18-8-7-16(12-17(14)18)21(25)22-13-19(20-6-5-11-26-20)24-9-3-4-10-24/h5-8,11-12,19,23H,3-4,9-10,13H2,1-2H3,(H,22,25)/p+1/t19-/m0/s1