4-ethyl-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-3-nitro-aniline

Systemtic Name: 4-ethyl-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-3-nitro-aniline Openeye Name: 4-ethyl-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]-3-nitro-aniline CAS Name: 4-ethyl-N-[[5-[(methylthio)methyl]-2-furanyl]methyl]-3-nitroaniline IUPAC Name: 4-ethyl-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-3-nitroaniline Traditional Name: (4-ethyl-3-nitro-phenyl)-[[5-[(methylthio)methyl]-2-furyl]methyl]amine Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NCC2=CC=C(O2)CSC)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NCC2=CC=C(O2)CSC)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O3S/c1-3-11-4-5-12(8-15(11)17(18)19)16-9-13-6-7-14(20-13)10-21-2/h4-8,16H,3,9-10H2,1-2H3