tert-butyl 2-[2-(2-naphthalen-1-ylethanethioylamino)ethylamino]hexanoate

Systemtic Name: tert-butyl 2-[2-(2-naphthalen-1-ylethanethioylamino)ethylamino]hexanoate Openeye Name: tert-butyl 2-[2-[[2-(1-naphthyl)ethanethioyl]amino]ethylamino]hexanoate CAS Name: 2-[2-[[2-(1-naphthalenyl)-1-sulfanylideneethyl]amino]ethylamino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-[(2-naphthalen-1-ylethanethioyl)amino]ethylamino]hexanoate Traditional Name: 2-[2-[[2-(1-naphthyl)thioacetyl]amino]ethylamino]hexanoic acid tert-butyl ester Formula: C24H34N2O2S MolecularWeight: 414.60396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC(C)(C)C)NCCNC(=S)CC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CCCCC(C(=O)OC(C)(C)C)NCCNC(=S)CC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C24H34N2O2S/c1-5-6-14-21(23(27)28-24(2,3)4)25-15-16-26-22(29)17-19-12-9-11-18-10-7-8-13-20(18)19/h7-13,21,25H,5-6,14-17H2,1-4H3,(H,26,29)