3-(2-tert-butyl-5-cyano-phenyl)-1-(4-chlorophenyl)-1-(2-dimethylaminoethyl)urea

Systemtic Name: 3-(2-tert-butyl-5-cyano-phenyl)-1-(4-chlorophenyl)-1-(2-dimethylaminoethyl)urea Openeye Name: 3-(2-tert-butyl-5-cyano-phenyl)-1-(4-chlorophenyl)-1-(2-dimethylaminoethyl)urea CAS Name: 3-(2-tert-butyl-5-cyanophenyl)-1-(4-chlorophenyl)-1-(2-dimethylaminoethyl)urea IUPAC Name: 3-(2-tert-butyl-5-cyanophenyl)-1-(4-chlorophenyl)-1-(2-dimethylaminoethyl)urea Traditional Name: 3-(2-tert-butyl-5-cyano-phenyl)-1-(4-chlorophenyl)-1-(2-dimethylaminoethyl)urea Formula: C22H27ClN4O MolecularWeight: 398.92898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C#N)NC(=O)N(CCN(C)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C#N)NC(=O)N(CCN(C)C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H27ClN4O/c1-22(2,3)19-11-6-16(15-24)14-20(19)25-21(28)27(13-12-26(4)5)18-9-7-17(23)8-10-18/h6-11,14H,12-13H2,1-5H3,(H,25,28)