tert-butyl-ethyl-[(1R)-2-oxidanylidene-2-piperazin-1-yl-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: tert-butyl-ethyl-[(1R)-2-oxidanylidene-2-piperazin-1-yl-1-thiophen-2-yl-ethyl]azanium Openeye Name: tert-butyl-ethyl-[(1R)-2-oxo-2-piperazin-1-yl-1-(2-thienyl)ethyl]ammonium CAS Name: tert-butyl-ethyl-[(1R)-2-oxo-2-(1-piperazinyl)-1-thiophen-2-ylethyl]ammonium IUPAC Name: tert-butyl-ethyl-[(1R)-2-oxo-2-piperazin-1-yl-1-thiophen-2-ylethyl]azanium Traditional Name: tert-butyl-ethyl-[(1R)-2-keto-2-piperazino-1-(2-thienyl)ethyl]ammonium Formula: C16H28N3OS+ MolecularWeight: 310.47802

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](C(C1=CC=CS1)C(=O)N2CCNCC2)C(C)(C)C

Isomeric SMILES

CC[NH+]([C@@H](C1=CC=CS1)C(=O)N2CCNCC2)C(C)(C)C

InChI

InChI=1S/C16H27N3OS/c1-5-19(16(2,3)4)14(13-7-6-12-21-13)15(20)18-10-8-17-9-11-18/h6-7,12,14,17H,5,8-11H2,1-4H3/p+1/t14-/m0/s1