2-(dimethylamino)-5-nitro-N-[2-(phenylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 2-(dimethylamino)-5-nitro-N-[2-(phenylmethylsulfanyl)ethyl]benzamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(dimethylamino)-5-nitro-benzamide CAS Name: 2-(dimethylamino)-5-nitro-N-[2-(phenylmethylthio)ethyl]benzamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(dimethylamino)-5-nitrobenzamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(dimethylamino)-5-nitro-benzamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C18H21N3O3S/c1-20(2)17-9-8-15(21(23)24)12-16(17)18(22)19-10-11-25-13-14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3,(H,19,22)