[2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxo-ethyl]-ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl]-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl]-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-keto-ethyl]-ethyl-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C19H29N4O2S+ MolecularWeight: 377.52416

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NCC1=CC=CS1)CC(=O)N(C)C2(CCCCC2)C#N

Isomeric SMILES

CC[NH+](CC(=O)NCC1=CC=CS1)CC(=O)N(C)C2(CCCCC2)C#N

InChI

InChI=1S/C19H28N4O2S/c1-3-23(13-17(24)21-12-16-8-7-11-26-16)14-18(25)22(2)19(15-20)9-5-4-6-10-19/h7-8,11H,3-6,9-10,12-14H2,1-2H3,(H,21,24)/p+1