2-(1H-benzimidazol-2-yl)-1-phenyl-4-(1,3,3-trimethylindol-2-ylidene)but-2-en-1-one

Systemtic Name: 2-(1H-benzimidazol-2-yl)-1-phenyl-4-(1,3,3-trimethylindol-2-ylidene)but-2-en-1-one Openeye Name: 2-(1H-benzimidazol-2-yl)-1-phenyl-4-(1,3,3-trimethylindolin-2-ylidene)but-2-en-1-one CAS Name: 2-(1H-benzimidazol-2-yl)-1-phenyl-4-(1,3,3-trimethyl-2-indolylidene)-2-buten-1-one IUPAC Name: 2-(1H-benzimidazol-2-yl)-1-phenyl-4-(1,3,3-trimethylindol-2-ylidene)but-2-en-1-one Traditional Name: 2-(1H-benzimidazol-2-yl)-1-phenyl-4-(1,3,3-trimethylindolin-2-ylidene)but-2-en-1-one Formula: C28H25N3O MolecularWeight: 419.5176

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC=C(C3=NC4=CC=CC=C4N3)C(=O)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC=C(C3=NC4=CC=CC=C4N3)C(=O)C5=CC=CC=C5)C)C

InChI

InChI=1S/C28H25N3O/c1-28(2)21-13-7-10-16-24(21)31(3)25(28)18-17-20(26(32)19-11-5-4-6-12-19)27-29-22-14-8-9-15-23(22)30-27/h4-18H,1-3H3,(H,29,30)