1-[2-butyl-3-[(5-chloranyl-2-cyano-3-phenyl-phenyl)methyl]benzimidazol-5-yl]-3-cyclohexyl-urea

Systemtic Name: 1-[2-butyl-3-[(5-chloranyl-2-cyano-3-phenyl-phenyl)methyl]benzimidazol-5-yl]-3-cyclohexyl-urea Openeye Name: 1-[2-butyl-3-[(5-chloro-2-cyano-3-phenyl-phenyl)methyl]benzimidazol-5-yl]-3-cyclohexyl-urea CAS Name: 1-[2-butyl-3-[(5-chloro-2-cyano-3-phenylphenyl)methyl]-5-benzimidazolyl]-3-cyclohexylurea IUPAC Name: 1-[2-butyl-3-[(5-chloro-2-cyano-3-phenylphenyl)methyl]benzimidazol-5-yl]-3-cyclohexylurea Traditional Name: 1-[2-butyl-3-(5-chloro-2-cyano-3-phenyl-benzyl)benzimidazol-5-yl]-3-cyclohexyl-urea Formula: C32H34ClN5O MolecularWeight: 540.09826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=C(C(=CC(=C3)Cl)C4=CC=CC=C4)C#N)C=C(C=C2)NC(=O)NC5CCCCC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=C(C(=CC(=C3)Cl)C4=CC=CC=C4)C#N)C=C(C=C2)NC(=O)NC5CCCCC5

InChI

InChI=1S/C32H34ClN5O/c1-2-3-14-31-37-29-16-15-26(36-32(39)35-25-12-8-5-9-13-25)19-30(29)38(31)21-23-17-24(33)18-27(28(23)20-34)22-10-6-4-7-11-22/h4,6-7,10-11,15-19,25H,2-3,5,8-9,12-14,21H2,1H3,(H2,35,36,39)