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

Systemtic Name: [[2-(2,3-dihydro-1H-indol-3-yl)ethylamino]-ethylsulfanyl-methylidene]-prop-2-enyl-azanium Openeye Name: allyl-[ethylsulfanyl-(2-indolin-3-ylethylamino)methylene]ammonium CAS Name: [[2-(2,3-dihydro-1H-indol-3-yl)ethylamino]-(ethylthio)methylidene]-prop-2-enylammonium IUPAC Name: [[2-(2,3-dihydro-1H-indol-3-yl)ethylamino]-ethylsulfanylmethylidene]-prop-2-enylazanium Traditional Name: allyl-[(ethylthio)-(2-indolin-3-ylethylamino)methylene]ammonium Formula: C16H24N3S+ MolecularWeight: 290.44686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3S/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)/p+1