N-[6-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-2-phenyl-cyclohexa-2,4-dien-1-ylidene]-2-methanoyl-benzamide

Systemtic Name: N-[6-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-2-phenyl-cyclohexa-2,4-dien-1-ylidene]-2-methanoyl-benzamide Openeye Name: N-[6-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-2-phenyl-cyclohexa-2,4-dien-1-ylidene]-2-formyl-benzamide CAS Name: N-[6-[[2-butyl-6-[[(cyclohexylamino)-oxomethyl]amino]-1-benzimidazolyl]methyl]-2-phenyl-1-cyclohexa-2,4-dienylidene]-2-formylbenzamide IUPAC Name: N-[6-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-2-phenylcyclohexa-2,4-dien-1-ylidene]-2-formylbenzamide Traditional Name: N-[6-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-2-phenyl-cyclohexa-2,4-dien-1-ylidene]-2-formyl-benzamide Formula: C39H41N5O3 MolecularWeight: 627.77454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3C=CC=C(C3=NC(=O)C4=CC=CC=C4C=O)C5=CC=CC=C5)C=C(C=C2)NC(=O)NC6CCCCC6

Isomeric SMILES

CCCCC1=NC2=C(N1CC3C=CC=C(C3=NC(=O)C4=CC=CC=C4C=O)C5=CC=CC=C5)C=C(C=C2)NC(=O)NC6CCCCC6

InChI

InChI=1S/C39H41N5O3/c1-2-3-21-36-42-34-23-22-31(41-39(47)40-30-17-8-5-9-18-30)24-35(34)44(36)25-28-16-12-20-32(27-13-6-4-7-14-27)37(28)43-38(46)33-19-11-10-15-29(33)26-45/h4,6-7,10-16,19-20,22-24,26,28,30H,2-3,5,8-9,17-18,21,25H2,1H3,(H2,40,41,47)