ethyl-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: ethyl-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: ethyl-[2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl]-(2-thienylmethyl)ammonium CAS Name: ethyl-[2-oxo-2-[4-(1-piperidinylsulfonyl)anilino]ethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: ethyl-[2-oxo-2-(4-piperidin-1-ylsulfonylanilino)ethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: ethyl-[2-keto-2-(4-piperidinosulfonylanilino)ethyl]-(2-thenyl)ammonium Formula: C20H28N3O3S2+ MolecularWeight: 422.58462

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CS1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC[NH+](CC1=CC=CS1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H27N3O3S2/c1-2-22(15-18-7-6-14-27-18)16-20(24)21-17-8-10-19(11-9-17)28(25,26)23-12-4-3-5-13-23/h6-11,14H,2-5,12-13,15-16H2,1H3,(H,21,24)/p+1