1-(2-chloranyl-4-nitro-phenyl)-3-(2-ethylhexyl)thiourea

Systemtic Name: 1-(2-chloranyl-4-nitro-phenyl)-3-(2-ethylhexyl)thiourea Openeye Name: 1-(2-chloro-4-nitro-phenyl)-3-(2-ethylhexyl)thiourea CAS Name: 1-(2-chloro-4-nitrophenyl)-3-(2-ethylhexyl)thiourea IUPAC Name: 1-(2-chloro-4-nitrophenyl)-3-(2-ethylhexyl)thiourea Traditional Name: 1-(2-chloro-4-nitro-phenyl)-3-(2-ethylhexyl)thiourea Formula: C15H22ClN3O2S MolecularWeight: 343.87208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCC(CC)CNC(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H22ClN3O2S/c1-3-5-6-11(4-2)10-17-15(22)18-14-8-7-12(19(20)21)9-13(14)16/h7-9,11H,3-6,10H2,1-2H3,(H2,17,18,22)