1-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-2-phenyl-indole-3-carboxamide

Systemtic Name: 1-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-2-phenyl-indole-3-carboxamide Openeye Name: 1-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-2-phenyl-indole-3-carboxamide CAS Name: 1-methyl-N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-2-phenyl-3-indolecarboxamide IUPAC Name: 1-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-2-phenylindole-3-carboxamide Traditional Name: 1-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-2-phenyl-indole-3-carboxamide Formula: C26H28N3O2S+ MolecularWeight: 446.58442

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)NCC(C4=CC=CS4)[NH+]5CCOCC5

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)NC[C@@H](C4=CC=CS4)[NH+]5CCOCC5

InChI

InChI=1S/C26H27N3O2S/c1-28-21-11-6-5-10-20(21)24(25(28)19-8-3-2-4-9-19)26(30)27-18-22(23-12-7-17-32-23)29-13-15-31-16-14-29/h2-12,17,22H,13-16,18H2,1H3,(H,27,30)/p+1/t22-/m0/s1