N-methyl-N-[(5-methylfuran-2-yl)methyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-methyl-N-[(5-methyl-2-furyl)methyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-methyl-N-[(5-methyl-2-furanyl)methyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-methyl-N-[(5-methyl-2-furyl)methyl]-4-(methylthio)-3-nitro-benzamide Formula: C15H16N2O4S MolecularWeight: 320.36354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O4S/c1-10-4-6-12(21-10)9-16(2)15(18)11-5-7-14(22-3)13(8-11)17(19)20/h4-8H,9H2,1-3H3