1-[4-chloranyl-3-(diethylsulfamoyl)phenyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea

Systemtic Name: 1-[4-chloranyl-3-(diethylsulfamoyl)phenyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Openeye Name: 1-[4-chloro-3-(diethylsulfamoyl)phenyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-[4-chloro-3-(diethylsulfamoyl)phenyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-[4-chloro-3-(diethylsulfamoyl)phenyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-[4-chloro-3-(diethylsulfamoyl)phenyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C18H28ClN3O2S2 MolecularWeight: 418.01682

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=S)NC2CCCCC2C)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=S)N[C@H]2CCCC[C@@H]2C)Cl

InChI

InChI=1S/C18H28ClN3O2S2/c1-4-22(5-2)26(23,24)17-12-14(10-11-15(17)19)20-18(25)21-16-9-7-6-8-13(16)3/h10-13,16H,4-9H2,1-3H3,(H2,20,21,25)/t13-,16-/m0/s1