5-nitro-2-(2-thiophen-3-ylethylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(2-thiophen-3-ylethylamino)benzenecarbonitrile Openeye Name: 5-nitro-2-[2-(3-thienyl)ethylamino]benzonitrile CAS Name: 5-nitro-2-[2-(3-thiophenyl)ethylamino]benzonitrile IUPAC Name: 5-nitro-2-(2-thiophen-3-ylethylamino)benzonitrile Traditional Name: 5-nitro-2-[2-(3-thienyl)ethylamino]benzonitrile Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NCCC2=CSC=C2

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NCCC2=CSC=C2

InChI

InChI=1S/C13H11N3O2S/c14-8-11-7-12(16(17)18)1-2-13(11)15-5-3-10-4-6-19-9-10/h1-2,4,6-7,9,15H,3,5H2