1-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]thiourea Openeye Name: [(E)-(4-chloro-3-nitro-phenyl)methyleneamino]thiourea CAS Name: [(E)-(4-chloro-3-nitrophenyl)methylideneamino]thiourea IUPAC Name: [(E)-(4-chloro-3-nitrophenyl)methylideneamino]thiourea Traditional Name: [(E)-(4-chloro-3-nitro-benzylidene)amino]thiourea Formula: C8H7ClN4O2S MolecularWeight: 258.68478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=NNC(=S)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1/C=N/NC(=S)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C8H7ClN4O2S/c9-6-2-1-5(3-7(6)13(14)15)4-11-12-8(10)16/h1-4H,(H3,10,12,16)/b11-4+