2-[(5-bromanylthiophen-2-yl)methylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(5-bromanylthiophen-2-yl)methylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(5-bromo-2-thienyl)methylamino]-5-nitro-benzonitrile CAS Name: 2-[(5-bromo-2-thiophenyl)methylamino]-5-nitrobenzonitrile IUPAC Name: 2-[(5-bromothiophen-2-yl)methylamino]-5-nitrobenzonitrile Traditional Name: 2-[(5-bromo-2-thienyl)methylamino]-5-nitro-benzonitrile Formula: C12H8BrN3O2S MolecularWeight: 338.17982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8BrN3O2S/c13-12-4-2-10(19-12)7-15-11-3-1-9(16(17)18)5-8(11)6-14/h1-5,15H,7H2