[2-(tert-butylamino)-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-ethyl-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-ethyl-[2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl]ammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-ethyl-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]azanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-ethyl-[2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl]ammonium Formula: C20H33N4O4S+ MolecularWeight: 425.56542

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)CC(=O)NC(C)(C)C

Isomeric SMILES

CC[NH+](CC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)CC(=O)NC(C)(C)C

InChI

InChI=1S/C20H32N4O4S/c1-5-23(15-19(26)22-20(2,3)4)14-18(25)21-16-9-8-10-17(13-16)29(27,28)24-11-6-7-12-24/h8-10,13H,5-7,11-12,14-15H2,1-4H3,(H,21,25)(H,22,26)/p+1