3-[[(Z)-1-(methylamino)-2-nitro-ethenyl]amino]propyl carbamimidothioate

Systemtic Name: 3-[[(Z)-1-(methylamino)-2-nitro-ethenyl]amino]propyl carbamimidothioate Openeye Name: 2-[3-[[(Z)-1-(methylamino)-2-nitro-vinyl]amino]propyl]isothiourea CAS Name: carbamimidothioic acid 3-[[(Z)-1-(methylamino)-2-nitroethenyl]amino]propyl ester IUPAC Name: 3-[[(Z)-1-(methylamino)-2-nitroethenyl]amino]propyl carbamimidothioate Traditional Name: 2-[3-[[(Z)-1-(methylamino)-2-nitro-vinyl]amino]propyl]isothiourea Formula: C7H15N5O2S MolecularWeight: 233.2913

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=C[N+](=O)[O-])NCCCSC(=N)N

Isomeric SMILES

CN/C(=C/[N+](=O)[O-])/NCCCSC(=N)N

InChI

InChI=1S/C7H15N5O2S/c1-10-6(5-12(13)14)11-3-2-4-15-7(8)9/h5,10-11H,2-4H2,1H3,(H3,8,9)/b6-5-