(E)-N-[5-[1-[(4-butan-2-ylphenyl)methyl]benzimidazol-2-yl]pentyl]but-2-enamide

Systemtic Name: (E)-N-[5-[1-[(4-butan-2-ylphenyl)methyl]benzimidazol-2-yl]pentyl]but-2-enamide Openeye Name: (E)-N-[5-[1-[(4-sec-butylphenyl)methyl]benzimidazol-2-yl]pentyl]but-2-enamide CAS Name: (E)-N-[5-[1-[(4-butan-2-ylphenyl)methyl]-2-benzimidazolyl]pentyl]-2-butenamide IUPAC Name: (E)-N-[5-[1-[(4-butan-2-ylphenyl)methyl]benzimidazol-2-yl]pentyl]but-2-enamide Traditional Name: (E)-N-[5-[1-(4-sec-butylbenzyl)benzimidazol-2-yl]pentyl]but-2-enamide Formula: C27H35N3O MolecularWeight: 417.5863

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CCCCCNC(=O)C=CC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CCCCCNC(=O)/C=C/C

InChI

InChI=1S/C27H35N3O/c1-4-11-27(31)28-19-10-6-7-14-26-29-24-12-8-9-13-25(24)30(26)20-22-15-17-23(18-16-22)21(3)5-2/h4,8-9,11-13,15-18,21H,5-7,10,14,19-20H2,1-3H3,(H,28,31)/b11-4+