N-(2-methoxyethyl)-4-(3-methylbutylsulfanyl)-3-nitro-benzamide

Systemtic Name: N-(2-methoxyethyl)-4-(3-methylbutylsulfanyl)-3-nitro-benzamide Openeye Name: 4-isopentylsulfanyl-N-(2-methoxyethyl)-3-nitro-benzamide CAS Name: N-(2-methoxyethyl)-4-(3-methylbutylthio)-3-nitrobenzamide IUPAC Name: N-(2-methoxyethyl)-4-(3-methylbutylsulfanyl)-3-nitrobenzamide Traditional Name: 4-(isoamylthio)-N-(2-methoxyethyl)-3-nitro-benzamide Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O4S/c1-11(2)6-9-22-14-5-4-12(10-13(14)17(19)20)15(18)16-7-8-21-3/h4-5,10-11H,6-9H2,1-3H3,(H,16,18)