3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(1-methylbenzimidazol-2-yl)methyl]benzamide

Systemtic Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(1-methylbenzimidazol-2-yl)methyl]benzamide Openeye Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(1-methylbenzimidazol-2-yl)methyl]benzamide CAS Name: 3-[[4-(4-acetamidophenyl)-2-pyrimidinyl]amino]-N-[(1-methyl-2-benzimidazolyl)methyl]benzamide IUPAC Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(1-methylbenzimidazol-2-yl)methyl]benzamide Traditional Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(1-methylbenzimidazol-2-yl)methyl]benzamide Formula: C28H25N7O2 MolecularWeight: 491.5438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)NCC4=NC5=CC=CC=C5N4C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)NCC4=NC5=CC=CC=C5N4C

InChI

InChI=1S/C28H25N7O2/c1-18(36)31-21-12-10-19(11-13-21)23-14-15-29-28(34-23)32-22-7-5-6-20(16-22)27(37)30-17-26-33-24-8-3-4-9-25(24)35(26)2/h3-16H,17H2,1-2H3,(H,30,37)(H,31,36)(H,29,32,34)