N-(5-methylhexan-2-yl)-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-(5-methylhexan-2-yl)-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-(1,4-dimethylpentyl)-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-(5-methylhexan-2-yl)-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-(5-methylhexan-2-yl)-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-(1,4-dimethylpentyl)-2-[(4-nitrophenyl)thio]acetamide Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3S/c1-11(2)4-5-12(3)16-15(18)10-21-14-8-6-13(7-9-14)17(19)20/h6-9,11-12H,4-5,10H2,1-3H3,(H,16,18)