3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-(phenylmethyl)benzamide

Systemtic Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-(phenylmethyl)benzamide Openeye Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-benzyl-benzamide CAS Name: 3-[1-[[4-(1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-N-(phenylmethyl)benzamide IUPAC Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-benzylbenzamide Traditional Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-benzyl-benzamide Formula: C27H24N6O MolecularWeight: 448.51906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)NCC2=CC=CC=C2)NC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)NCC2=CC=CC=C2)NC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C27H24N6O/c1-19(21-10-7-11-22(16-21)26(34)29-17-20-8-3-2-4-9-20)31-27-28-15-14-25(32-27)33-18-30-23-12-5-6-13-24(23)33/h2-16,18-19H,17H2,1H3,(H,29,34)(H,28,31,32)