3-[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]-2-(2-methylindol-1-yl)benzenecarbonitrile

Systemtic Name: 3-[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]-2-(2-methylindol-1-yl)benzenecarbonitrile Openeye Name: 3-[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]-2-(2-methylindol-1-yl)benzonitrile CAS Name: 3-[2-butyl-4-chloro-5-(hydroxymethyl)-1-imidazolyl]-2-(2-methyl-1-indolyl)benzonitrile IUPAC Name: 3-[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]-2-(2-methylindol-1-yl)benzonitrile Traditional Name: 3-(2-butyl-4-chloro-5-methylol-imidazol-1-yl)-2-(2-methylindol-1-yl)benzonitrile Formula: C24H23ClN4O MolecularWeight: 418.91862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1C2=CC=CC(=C2N3C(=CC4=CC=CC=C43)C)C#N)CO)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1C2=CC=CC(=C2N3C(=CC4=CC=CC=C43)C)C#N)CO)Cl

InChI

InChI=1S/C24H23ClN4O/c1-3-4-12-22-27-24(25)21(15-30)29(22)20-11-7-9-18(14-26)23(20)28-16(2)13-17-8-5-6-10-19(17)28/h5-11,13,30H,3-4,12,15H2,1-2H3