3-(4-chloranyl-3-methylsulfanyl-phenyl)-1-(3,3-diphenylpropyl)-1-(2-morpholin-4-ylethyl)urea

Systemtic Name: 3-(4-chloranyl-3-methylsulfanyl-phenyl)-1-(3,3-diphenylpropyl)-1-(2-morpholin-4-ylethyl)urea Openeye Name: 3-(4-chloro-3-methylsulfanyl-phenyl)-1-(3,3-diphenylpropyl)-1-(2-morpholinoethyl)urea CAS Name: 3-[4-chloro-3-(methylthio)phenyl]-1-(3,3-diphenylpropyl)-1-[2-(4-morpholinyl)ethyl]urea IUPAC Name: 3-(4-chloro-3-methylsulfanylphenyl)-1-(3,3-diphenylpropyl)-1-(2-morpholin-4-ylethyl)urea Traditional Name: 3-[4-chloro-3-(methylthio)phenyl]-1-(3,3-diphenylpropyl)-1-(2-morpholinoethyl)urea Formula: C29H34ClN3O2S MolecularWeight: 524.11716

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1)NC(=O)N(CCC(C2=CC=CC=C2)C3=CC=CC=C3)CCN4CCOCC4)Cl

Isomeric SMILES

CSC1=C(C=CC(=C1)NC(=O)N(CCC(C2=CC=CC=C2)C3=CC=CC=C3)CCN4CCOCC4)Cl

InChI

InChI=1S/C29H34ClN3O2S/c1-36-28-22-25(12-13-27(28)30)31-29(34)33(17-16-32-18-20-35-21-19-32)15-14-26(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-13,22,26H,14-21H2,1H3,(H,31,34)