2-[4-[[[(E)-2-nitro-1-thionitroso-but-1-enyl]amino]methyl]-1,3-thiazol-2-yl]guanidine

Systemtic Name: 2-[4-[[[(E)-2-nitro-1-thionitroso-but-1-enyl]amino]methyl]-1,3-thiazol-2-yl]guanidine Openeye Name: 2-[4-[[[(E)-2-nitro-1-thionitroso-but-1-enyl]amino]methyl]thiazol-2-yl]guanidine CAS Name: 2-[4-[[[(E)-2-nitro-1-thionitrosobut-1-enyl]amino]methyl]-2-thiazolyl]guanidine IUPAC Name: 2-[4-[[[(E)-2-nitro-1-thionitrosobut-1-enyl]amino]methyl]-1,3-thiazol-2-yl]guanidine Traditional Name: 2-[4-[[[(E)-2-nitro-1-thionitroso-but-1-enyl]amino]methyl]thiazol-2-yl]guanidine Formula: C9H13N7O2S2 MolecularWeight: 315.37522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(NCC1=CSC(=N1)N=C(N)N)N=S)[N+](=O)[O-]

Isomeric SMILES

CC/C(=C(/NCC1=CSC(=N1)N=C(N)N)\N=S)/[N+](=O)[O-]

InChI

InChI=1S/C9H13N7O2S2/c1-2-6(16(17)18)7(15-19)12-3-5-4-20-9(13-5)14-8(10)11/h4,12H,2-3H2,1H3,(H4,10,11,13,14)/b7-6+