N-[2-(dimethylamino)-3-methyl-butyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[2-(dimethylamino)-3-methylbutyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[2-(dimethylamino)-3-methylbutyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-(methylthio)-3-nitro-benzamide Formula: C15H23N3O3S MolecularWeight: 325.42642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O3S/c1-10(2)13(17(3)4)9-16-15(19)11-6-7-14(22-5)12(8-11)18(20)21/h6-8,10,13H,9H2,1-5H3,(H,16,19)