6-bromanyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-1H-indole-2-carboxamide

Systemtic Name: 6-bromanyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-1H-indole-2-carboxamide Openeye Name: 6-bromo-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-1H-indole-2-carboxamide CAS Name: 6-bromo-N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-1H-indole-2-carboxamide IUPAC Name: 6-bromo-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-1H-indole-2-carboxamide Traditional Name: 6-bromo-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-1H-indole-2-carboxamide Formula: C19H21BrN3O2S+ MolecularWeight: 435.35794

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC3=C(N2)C=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=CC3=C(N2)C=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C19H20BrN3O2S/c20-14-4-3-13-10-16(22-15(13)11-14)19(24)21-12-17(18-2-1-9-26-18)23-5-7-25-8-6-23/h1-4,9-11,17,22H,5-8,12H2,(H,21,24)/p+1/t17-/m0/s1