1-ethyl-3-(5-nitro-2-oxidanyl-phenyl)thiourea

Systemtic Name: 1-ethyl-3-(5-nitro-2-oxidanyl-phenyl)thiourea Openeye Name: 1-ethyl-3-(2-hydroxy-5-nitro-phenyl)thiourea CAS Name: 1-ethyl-3-(2-hydroxy-5-nitrophenyl)thiourea IUPAC Name: 1-ethyl-3-(2-hydroxy-5-nitrophenyl)thiourea Traditional Name: 1-ethyl-3-(2-hydroxy-5-nitro-phenyl)thiourea Formula: C9H11N3O3S MolecularWeight: 241.26694

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])O

Isomeric SMILES

CCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])O

InChI

InChI=1S/C9H11N3O3S/c1-2-10-9(16)11-7-5-6(12(14)15)3-4-8(7)13/h3-5,13H,2H2,1H3,(H2,10,11,16)