N-cyclopropyl-N-(2-hydroxyethyl)-5-methylsulfanyl-2-nitro-benzamide

Systemtic Name: N-cyclopropyl-N-(2-hydroxyethyl)-5-methylsulfanyl-2-nitro-benzamide Openeye Name: N-cyclopropyl-N-(2-hydroxyethyl)-5-methylsulfanyl-2-nitro-benzamide CAS Name: N-cyclopropyl-N-(2-hydroxyethyl)-5-(methylthio)-2-nitrobenzamide IUPAC Name: N-cyclopropyl-N-(2-hydroxyethyl)-5-methylsulfanyl-2-nitrobenzamide Traditional Name: N-cyclopropyl-N-(2-hydroxyethyl)-5-(methylthio)-2-nitro-benzamide Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)N(CCO)C2CC2

Isomeric SMILES

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)N(CCO)C2CC2

InChI

InChI=1S/C13H16N2O4S/c1-20-10-4-5-12(15(18)19)11(8-10)13(17)14(6-7-16)9-2-3-9/h4-5,8-9,16H,2-3,6-7H2,1H3