1-(3-chlorophenyl)-3-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-1-methyl-3-pentyl-urea

Systemtic Name: 1-(3-chlorophenyl)-3-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-1-methyl-3-pentyl-urea Openeye Name: 1-(3-chlorophenyl)-3-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-1-methyl-3-pentyl-urea CAS Name: 1-(3-chlorophenyl)-3-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]methyl]-1-methyl-3-pentylurea IUPAC Name: 1-(3-chlorophenyl)-3-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-1-methyl-3-pentylurea Traditional Name: 1-amyl-3-(3-chlorophenyl)-1-[[3-(4-cyanobenzyl)imidazol-4-yl]methyl]-3-methyl-urea Formula: C25H28ClN5O MolecularWeight: 449.97572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CN=CN1CC2=CC=C(C=C2)C#N)C(=O)N(C)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCN(CC1=CN=CN1CC2=CC=C(C=C2)C#N)C(=O)N(C)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C25H28ClN5O/c1-3-4-5-13-30(25(32)29(2)23-8-6-7-22(26)14-23)18-24-16-28-19-31(24)17-21-11-9-20(15-27)10-12-21/h6-12,14,16,19H,3-5,13,17-18H2,1-2H3