[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: [2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: [2-(2-cyanoanilino)-2-oxo-ethyl]-ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: [2-(2-cyanoanilino)-2-oxoethyl]-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: [2-(2-cyanoanilino)-2-oxoethyl]-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: [2-(2-cyanoanilino)-2-keto-ethyl]-ethyl-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C18H21N4O2S+ MolecularWeight: 357.44994

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NCC1=CC=CS1)CC(=O)NC2=CC=CC=C2C#N

Isomeric SMILES

CC[NH+](CC(=O)NCC1=CC=CS1)CC(=O)NC2=CC=CC=C2C#N

InChI

InChI=1S/C18H20N4O2S/c1-2-22(12-17(23)20-11-15-7-5-9-25-15)13-18(24)21-16-8-4-3-6-14(16)10-19/h3-9H,2,11-13H2,1H3,(H,20,23)(H,21,24)/p+1