ethyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: ethyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: ethyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl]-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: ethyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: ethyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: ethyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl]-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C21H27N4O2S+ MolecularWeight: 399.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NCCC1=CNC2=CC=CC=C21)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CC[NH+](CC(=O)NCCC1=CNC2=CC=CC=C21)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C21H26N4O2S/c1-2-25(15-21(27)24-13-17-6-5-11-28-17)14-20(26)22-10-9-16-12-23-19-8-4-3-7-18(16)19/h3-8,11-12,23H,2,9-10,13-15H2,1H3,(H,22,26)(H,24,27)/p+1