N-[(5-bromanylthiophen-2-yl)methyl]-N-methyl-2,4-dinitro-aniline

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-N-methyl-2,4-dinitro-aniline Openeye Name: N-[(5-bromo-2-thienyl)methyl]-N-methyl-2,4-dinitro-aniline CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-N-methyl-2,4-dinitroaniline IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-N-methyl-2,4-dinitroaniline Traditional Name: (5-bromo-2-thienyl)methyl-(2,4-dinitrophenyl)-methyl-amine Formula: C12H10BrN3O4S MolecularWeight: 372.1945

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Br)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(S1)Br)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H10BrN3O4S/c1-14(7-9-3-5-12(13)21-9)10-4-2-8(15(17)18)6-11(10)16(19)20/h2-6H,7H2,1H3