[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl]-(2-furylmethyl)-(2-thienylmethyl)ammonium CAS Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-(2-furanylmethyl)-(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium Traditional Name: [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl]-(2-furfuryl)-(2-thenyl)ammonium Formula: C18H22N3O2S+ MolecularWeight: 344.45118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CS3

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CS3

InChI

InChI=1S/C18H21N3O2S/c19-14-18(7-1-2-8-18)20-17(22)13-21(11-15-5-3-9-23-15)12-16-6-4-10-24-16/h3-6,9-10H,1-2,7-8,11-13H2,(H,20,22)/p+1