2-[[3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]methylideneamino]guanidine

Systemtic Name: 2-[[3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]methylideneamino]guanidine Openeye Name: 2-[[3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]methyleneamino]guanidine CAS Name: 2-[[3-nitro-4-(1H-1,2,4-triazol-5-ylthio)phenyl]methylideneamino]guanidine IUPAC Name: 2-[[3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]methylideneamino]guanidine Traditional Name: 2-[[3-nitro-4-(1H-1,2,4-triazol-5-ylthio)benzylidene]amino]guanidine Formula: C10H10N8O2S MolecularWeight: 306.3038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=NN=C(N)N)[N+](=O)[O-])SC2=NC=NN2

Isomeric SMILES

C1=CC(=C(C=C1C=NN=C(N)N)[N+](=O)[O-])SC2=NC=NN2

InChI

InChI=1S/C10H10N8O2S/c11-9(12)16-14-4-6-1-2-8(7(3-6)18(19)20)21-10-13-5-15-17-10/h1-5H,(H4,11,12,16)(H,13,15,17)