3-[3-chloranyl-4-(2-methylsulfanyl-3-phenyl-propoxy)phenyl]-1,1-dimethyl-urea

Systemtic Name: 3-[3-chloranyl-4-(2-methylsulfanyl-3-phenyl-propoxy)phenyl]-1,1-dimethyl-urea Openeye Name: 3-[3-chloro-4-(2-methylsulfanyl-3-phenyl-propoxy)phenyl]-1,1-dimethyl-urea CAS Name: 3-[3-chloro-4-[2-(methylthio)-3-phenylpropoxy]phenyl]-1,1-dimethylurea IUPAC Name: 3-[3-chloro-4-(2-methylsulfanyl-3-phenylpropoxy)phenyl]-1,1-dimethylurea Traditional Name: 3-[3-chloro-4-[2-(methylthio)-3-phenyl-propoxy]phenyl]-1,1-dimethyl-urea Formula: C19H23ClN2O2S MolecularWeight: 378.91612

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=CC(=C(C=C1)OCC(CC2=CC=CC=C2)SC)Cl

Isomeric SMILES

CN(C)C(=O)NC1=CC(=C(C=C1)OCC(CC2=CC=CC=C2)SC)Cl

InChI

InChI=1S/C19H23ClN2O2S/c1-22(2)19(23)21-15-9-10-18(17(20)12-15)24-13-16(25-3)11-14-7-5-4-6-8-14/h4-10,12,16H,11,13H2,1-3H3,(H,21,23)