N-(2-cyclohexylsulfanylethyl)-3-nitro-benzamide

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-3-nitro-benzamide Openeye Name: N-(2-cyclohexylsulfanylethyl)-3-nitro-benzamide CAS Name: N-[2-(cyclohexylthio)ethyl]-3-nitrobenzamide IUPAC Name: N-(2-cyclohexylsulfanylethyl)-3-nitrobenzamide Traditional Name: N-[2-(cyclohexylthio)ethyl]-3-nitro-benzamide Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)SCCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O3S/c18-15(12-5-4-6-13(11-12)17(19)20)16-9-10-21-14-7-2-1-3-8-14/h4-6,11,14H,1-3,7-10H2,(H,16,18)