3-[2-(1H-benzimidazol-2-yl)ethylamino]-5-phenyl-2-propanoyl-cyclohex-2-en-1-one

Systemtic Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5-phenyl-2-propanoyl-cyclohex-2-en-1-one Openeye Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5-phenyl-2-propanoyl-cyclohex-2-en-1-one CAS Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-2-(1-oxopropyl)-5-phenyl-1-cyclohex-2-enone IUPAC Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5-phenyl-2-propanoylcyclohex-2-en-1-one Traditional Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5-phenyl-2-propionyl-cyclohex-2-en-1-one Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H25N3O2/c1-2-21(28)24-20(14-17(15-22(24)29)16-8-4-3-5-9-16)25-13-12-23-26-18-10-6-7-11-19(18)27-23/h3-11,17,25H,2,12-15H2,1H3,(H,26,27)