1-[2,2-bis(4-chlorophenyl)-3-(dimethylaminomethyl)pentyl]urea

Systemtic Name: 1-[2,2-bis(4-chlorophenyl)-3-(dimethylaminomethyl)pentyl]urea Openeye Name: [2,2-bis(4-chlorophenyl)-3-(dimethylaminomethyl)pentyl]urea CAS Name: [2,2-bis(4-chlorophenyl)-3-(dimethylaminomethyl)pentyl]urea IUPAC Name: [2,2-bis(4-chlorophenyl)-3-(dimethylaminomethyl)pentyl]urea Traditional Name: [2,2-bis(4-chlorophenyl)-3-(dimethylaminomethyl)pentyl]urea Formula: C21H27Cl2N3O MolecularWeight: 408.36458

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(C)C)C(CNC(=O)N)(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(CN(C)C)C(CNC(=O)N)(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H27Cl2N3O/c1-4-15(13-26(2)3)21(14-25-20(24)27,16-5-9-18(22)10-6-16)17-7-11-19(23)12-8-17/h5-12,15H,4,13-14H2,1-3H3,(H3,24,25,27)