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

Systemtic Name: 1-cyclohexyl-3-(5-nitro-2-oxidanyl-phenyl)thiourea Openeye Name: 1-cyclohexyl-3-(2-hydroxy-5-nitro-phenyl)thiourea CAS Name: 1-cyclohexyl-3-(2-hydroxy-5-nitrophenyl)thiourea IUPAC Name: 1-cyclohexyl-3-(2-hydroxy-5-nitrophenyl)thiourea Traditional Name: 1-cyclohexyl-3-(2-hydroxy-5-nitro-phenyl)thiourea Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H17N3O3S/c17-12-7-6-10(16(18)19)8-11(12)15-13(20)14-9-4-2-1-3-5-9/h6-9,17H,1-5H2,(H2,14,15,20)