1-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-3-[(2S)-2-ethylhexyl]thiourea

Systemtic Name: 1-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-3-[(2S)-2-ethylhexyl]thiourea Openeye Name: 1-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-[(2S)-2-ethylhexyl]thiourea CAS Name: 1-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-[(2S)-2-ethylhexyl]thiourea IUPAC Name: 1-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-[(2S)-2-ethylhexyl]thiourea Traditional Name: 1-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-[(2S)-2-ethylhexyl]thiourea Formula: C17H28ClN3O2S2 MolecularWeight: 406.00612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N(C)C

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N(C)C

InChI

InChI=1S/C17H28ClN3O2S2/c1-5-7-8-13(6-2)12-19-17(24)20-14-9-10-15(18)16(11-14)25(22,23)21(3)4/h9-11,13H,5-8,12H2,1-4H3,(H2,19,20,24)/t13-/m0/s1