2-[2-(4-nitrophenyl)sulfanylethanoylamino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-(4-nitrophenyl)sulfanylethanoylamino]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]acetamide CAS Name: 2-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[[2-[(4-nitrophenyl)thio]acetyl]amino]acetamide Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CNC(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O4S/c1-9(2)15-12(17)7-14-13(18)8-21-11-5-3-10(4-6-11)16(19)20/h3-6,9H,7-8H2,1-2H3,(H,14,18)(H,15,17)