N-cyclopropyl-4-(3-methylbutylsulfanyl)-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-4-(3-methylbutylsulfanyl)-3-nitro-benzamide Openeye Name: N-cyclopropyl-4-isopentylsulfanyl-3-nitro-benzamide CAS Name: N-cyclopropyl-4-(3-methylbutylthio)-3-nitrobenzamide IUPAC Name: N-cyclopropyl-4-(3-methylbutylsulfanyl)-3-nitrobenzamide Traditional Name: N-cyclopropyl-4-(isoamylthio)-3-nitro-benzamide Formula: C15H20N2O3S MolecularWeight: 308.3959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=C(C=C(C=C1)C(=O)NC2CC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCSC1=C(C=C(C=C1)C(=O)NC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O3S/c1-10(2)7-8-21-14-6-3-11(9-13(14)17(19)20)15(18)16-12-4-5-12/h3,6,9-10,12H,4-5,7-8H2,1-2H3,(H,16,18)