1-(4-methylsulfanylphenyl)-N-[(5-nitrofuran-2-yl)methyl]ethanamine

Systemtic Name: 1-(4-methylsulfanylphenyl)-N-[(5-nitrofuran-2-yl)methyl]ethanamine Openeye Name: 1-(4-methylsulfanylphenyl)-N-[(5-nitro-2-furyl)methyl]ethanamine CAS Name: 1-[4-(methylthio)phenyl]-N-[(5-nitro-2-furanyl)methyl]ethanamine IUPAC Name: 1-(4-methylsulfanylphenyl)-N-[(5-nitrofuran-2-yl)methyl]ethanamine Traditional Name: 1-[4-(methylthio)phenyl]ethyl-[(5-nitro-2-furyl)methyl]amine Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)NCC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=C(C=C1)SC)NCC2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O3S/c1-10(11-3-6-13(20-2)7-4-11)15-9-12-5-8-14(19-12)16(17)18/h3-8,10,15H,9H2,1-2H3