3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-(2-hydroxyethyl)-1-(phenylmethyl)thiourea

Systemtic Name: 3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-(2-hydroxyethyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-(2-hydroxyethyl)thiourea CAS Name: 3-[5-(dimethylsulfamoyl)-2-methylphenyl]-1-(2-hydroxyethyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[5-(dimethylsulfamoyl)-2-methylphenyl]-1-(2-hydroxyethyl)thiourea Traditional Name: 1-benzyl-3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-(2-hydroxyethyl)thiourea Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)N(CCO)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)N(CCO)CC2=CC=CC=C2

InChI

InChI=1S/C19H25N3O3S2/c1-15-9-10-17(27(24,25)21(2)3)13-18(15)20-19(26)22(11-12-23)14-16-7-5-4-6-8-16/h4-10,13,23H,11-12,14H2,1-3H3,(H,20,26)