2-butylsulfanyl-N-(2-methyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-butylsulfanyl-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-butylsulfanyl-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-(butylthio)-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-butylsulfanyl-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-(butylthio)-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C

Isomeric SMILES

CCCCSCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C

InChI

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