1-(2-chloranyl-5-nitro-phenyl)-3-(4-oxidanylcyclohexyl)thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-(4-oxidanylcyclohexyl)thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-(4-hydroxycyclohexyl)thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-(4-hydroxycyclohexyl)thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-(4-hydroxycyclohexyl)thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-(4-hydroxycyclohexyl)thiourea Formula: C13H16ClN3O3S MolecularWeight: 329.80244

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)O

Isomeric SMILES

C1CC(CCC1NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)O

InChI

InChI=1S/C13H16ClN3O3S/c14-11-6-3-9(17(19)20)7-12(11)16-13(21)15-8-1-4-10(18)5-2-8/h3,6-8,10,18H,1-2,4-5H2,(H2,15,16,21)