N-butan-2-yl-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-butan-2-yl-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: 2-(4-nitrophenyl)sulfanyl-N-sec-butyl-propanamide CAS Name: N-butan-2-yl-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-butan-2-yl-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: 2-[(4-nitrophenyl)thio]-N-sec-butyl-propionamide Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3S/c1-4-9(2)14-13(16)10(3)19-12-7-5-11(6-8-12)15(17)18/h5-10H,4H2,1-3H3,(H,14,16)