1-(3-chloranyl-2-methyl-phenyl)-3-[4-(phenethylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[4-(phenethylsulfamoyl)phenyl]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[4-(phenethylsulfamoyl)phenyl]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[4-(phenethylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[4-(phenethylsulfamoyl)phenyl]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[4-(phenethylsulfamoyl)phenyl]thiourea Formula: C22H22ClN3O2S2 MolecularWeight: 460.01198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H22ClN3O2S2/c1-16-20(23)8-5-9-21(16)26-22(29)25-18-10-12-19(13-11-18)30(27,28)24-15-14-17-6-3-2-4-7-17/h2-13,24H,14-15H2,1H3,(H2,25,26,29)