(2R)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: (2R)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: (2R)-N-[2-(tert-butylamino)-2-oxo-ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: (2R)-N-[2-(tert-butylamino)-2-oxoethyl]-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: (2R)-N-[2-(tert-butylamino)-2-oxoethyl]-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: (2R)-N-[2-(tert-butylamino)-2-keto-ethyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)NC(C)(C)C)SC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NCC(=O)NC(C)(C)C)SC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O4S/c1-10(14(20)16-9-13(19)17-15(2,3)4)23-12-7-5-11(6-8-12)18(21)22/h5-8,10H,9H2,1-4H3,(H,16,20)(H,17,19)/t10-/m1/s1