2-ethyl-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]piperidine-1-carbothioamide

Systemtic Name: 2-ethyl-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]piperidine-1-carbothioamide Openeye Name: 2-ethyl-N-[(Z)-(5-nitro-2-furyl)methyleneamino]piperidine-1-carbothioamide CAS Name: 2-ethyl-N-[(Z)-(5-nitro-2-furanyl)methylideneamino]-1-piperidinecarbothioamide IUPAC Name: 2-ethyl-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]piperidine-1-carbothioamide Traditional Name: 2-ethyl-N-[(Z)-(5-nitro-2-furyl)methyleneamino]piperidine-1-carbothioamide Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=S)NN=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C(=S)N/N=C\C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O3S/c1-2-10-5-3-4-8-16(10)13(21)15-14-9-11-6-7-12(20-11)17(18)19/h6-7,9-10H,2-5,8H2,1H3,(H,15,21)/b14-9-