6-[[(Z)-1-(methylamino)-2-nitro-ethenyl]amino]hexyl carbamimidothioate

Systemtic Name: 6-[[(Z)-1-(methylamino)-2-nitro-ethenyl]amino]hexyl carbamimidothioate Openeye Name: 2-[6-[[(Z)-1-(methylamino)-2-nitro-vinyl]amino]hexyl]isothiourea CAS Name: carbamimidothioic acid 6-[[(Z)-1-(methylamino)-2-nitroethenyl]amino]hexyl ester IUPAC Name: 6-[[(Z)-1-(methylamino)-2-nitroethenyl]amino]hexyl carbamimidothioate Traditional Name: 2-[6-[[(Z)-1-(methylamino)-2-nitro-vinyl]amino]hexyl]isothiourea Formula: C10H21N5O2S MolecularWeight: 275.37104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H21N5O2S/c1-13-9(8-15(16)17)14-6-4-2-3-5-7-18-10(11)12/h8,13-14H,2-7H2,1H3,(H3,11,12)/b9-8-