N-methyl-4-(2-methylpropylsulfanyl)-3-nitro-N-phenyl-benzamide

Systemtic Name: N-methyl-4-(2-methylpropylsulfanyl)-3-nitro-N-phenyl-benzamide Openeye Name: 4-isobutylsulfanyl-N-methyl-3-nitro-N-phenyl-benzamide CAS Name: N-methyl-4-(2-methylpropylthio)-3-nitro-N-phenylbenzamide IUPAC Name: N-methyl-4-(2-methylpropylsulfanyl)-3-nitro-N-phenylbenzamide Traditional Name: 4-(isobutylthio)-N-methyl-3-nitro-N-phenyl-benzamide Formula: C18H20N2O3S MolecularWeight: 344.428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=C(C=C(C=C1)C(=O)N(C)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CSC1=C(C=C(C=C1)C(=O)N(C)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O3S/c1-13(2)12-24-17-10-9-14(11-16(17)20(22)23)18(21)19(3)15-7-5-4-6-8-15/h4-11,13H,12H2,1-3H3