N-[3-(4-fluorophenyl)sulfanylpropyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-3-methyl-4-nitro-benzamide CAS Name: N-[3-[(4-fluorophenyl)thio]propyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[3-[(4-fluorophenyl)thio]propyl]-3-methyl-4-nitro-benzamide Formula: C17H17FN2O3S MolecularWeight: 348.391883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCCSC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCCSC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H17FN2O3S/c1-12-11-13(3-8-16(12)20(22)23)17(21)19-9-2-10-24-15-6-4-14(18)5-7-15/h3-8,11H,2,9-10H2,1H3,(H,19,21)