N-ethenyl-1-[2-(piperidin-2-ylmethylamino)pyrimidin-4-yl]benzimidazole-5-carboxamide

Systemtic Name: N-ethenyl-1-[2-(piperidin-2-ylmethylamino)pyrimidin-4-yl]benzimidazole-5-carboxamide Openeye Name: 1-[2-(2-piperidylmethylamino)pyrimidin-4-yl]-N-vinyl-benzimidazole-5-carboxamide CAS Name: N-ethenyl-1-[2-(2-piperidinylmethylamino)-4-pyrimidinyl]-5-benzimidazolecarboxamide IUPAC Name: N-ethenyl-1-[2-(piperidin-2-ylmethylamino)pyrimidin-4-yl]benzimidazole-5-carboxamide Traditional Name: 1-[2-(2-piperidylmethylamino)pyrimidin-4-yl]-N-vinyl-benzimidazole-5-carboxamide Formula: C20H23N7O MolecularWeight: 377.44292

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Descriptors Computed from Structure

Canonical SMILES:

C=CNC(=O)C1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NCC4CCCCN4

Isomeric SMILES

C=CNC(=O)C1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NCC4CCCCN4

InChI

InChI=1S/C20H23N7O/c1-2-21-19(28)14-6-7-17-16(11-14)25-13-27(17)18-8-10-23-20(26-18)24-12-15-5-3-4-9-22-15/h2,6-8,10-11,13,15,22H,1,3-5,9,12H2,(H,21,28)(H,23,24,26)