[[2-(2,3-dihydro-1H-indol-3-yl)ethylamino]-ethylsulfanyl-methylidene]-prop-2-enyl-azanium iodide

Systemtic Name: [[2-(2,3-dihydro-1H-indol-3-yl)ethylamino]-ethylsulfanyl-methylidene]-prop-2-enyl-azanium iodide Openeye Name: allyl-[ethylsulfanyl-(2-indolin-3-ylethylamino)methylene]ammonium iodide CAS Name: [[2-(2,3-dihydro-1H-indol-3-yl)ethylamino]-(ethylthio)methylidene]-prop-2-enylammonium iodide IUPAC Name: [[2-(2,3-dihydro-1H-indol-3-yl)ethylamino]-ethylsulfanylmethylidene]-prop-2-enylazanium iodide Traditional Name: allyl-[(ethylthio)-(2-indolin-3-ylethylamino)methylene]ammonium iodide Formula: C16H24IN3S MolecularWeight: 417.35133

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=[NH+]CC=C)NCCC1CNC2=CC=CC=C12.[I-]

Isomeric SMILES

CCSC(=[NH+]CC=C)NCCC1CNC2=CC=CC=C12.[I-]

InChI

InChI=1S/C16H23N3S.HI/c1-3-10-17-16(20-4-2)18-11-9-13-12-19-15-8-6-5-7-14(13)15;/h3,5-8,13,19H,1,4,9-12H2,2H3,(H,17,18);1H