2-[2-(furan-2-ylmethylsulfanyl)ethylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[2-(furan-2-ylmethylsulfanyl)ethylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[2-(2-furylmethylsulfanyl)ethylamino]-5-nitro-benzonitrile CAS Name: 2-[2-(2-furanylmethylthio)ethylamino]-5-nitrobenzonitrile IUPAC Name: 2-[2-(furan-2-ylmethylsulfanyl)ethylamino]-5-nitrobenzonitrile Traditional Name: 2-[2-(2-furfurylthio)ethylamino]-5-nitro-benzonitrile Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSCCNC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=COC(=C1)CSCCNC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H13N3O3S/c15-9-11-8-12(17(18)19)3-4-14(11)16-5-7-21-10-13-2-1-6-20-13/h1-4,6,8,16H,5,7,10H2