N-[(5-bromanylthiophen-2-yl)methyl]-4-methyl-3-nitro-aniline

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-4-methyl-3-nitro-aniline Openeye Name: N-[(5-bromo-2-thienyl)methyl]-4-methyl-3-nitro-aniline CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-4-methyl-3-nitroaniline IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-4-methyl-3-nitroaniline Traditional Name: (5-bromo-2-thienyl)methyl-(4-methyl-3-nitro-phenyl)amine Formula: C12H11BrN2O2S MolecularWeight: 327.19694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CC=C(S2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CC=C(S2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H11BrN2O2S/c1-8-2-3-9(6-11(8)15(16)17)14-7-10-4-5-12(13)18-10/h2-6,14H,7H2,1H3