3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]-N-phenyl-benzimidazole-5-carboxamide

Systemtic Name: 3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]-N-phenyl-benzimidazole-5-carboxamide Openeye Name: 3-cyano-N-phenyl-4-(4-tetrahydropyran-4-ylpiperazin-1-yl)benzimidazole-5-carboxamide CAS Name: 3-cyano-4-[4-(4-oxanyl)-1-piperazinyl]-N-phenyl-5-benzimidazolecarboxamide IUPAC Name: 3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]-N-phenylbenzimidazole-5-carboxamide Traditional Name: 3-cyano-N-phenyl-4-(4-tetrahydropyran-4-ylpiperazino)benzimidazole-5-carboxamide Formula: C24H26N6O2 MolecularWeight: 430.50224

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1N2CCN(CC2)C3=C(C=CC4=C3N(C=N4)C#N)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1COCCC1N2CCN(CC2)C3=C(C=CC4=C3N(C=N4)C#N)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C24H26N6O2/c25-16-30-17-26-21-7-6-20(24(31)27-18-4-2-1-3-5-18)22(23(21)30)29-12-10-28(11-13-29)19-8-14-32-15-9-19/h1-7,17,19H,8-15H2,(H,27,31)