N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-(4-methylpiperazin-1-yl)but-2-ynamide

Systemtic Name: N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-(4-methylpiperazin-1-yl)but-2-ynamide Openeye Name: N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-(4-methylpiperazin-1-yl)but-2-ynamide CAS Name: N-[3-[6-(tert-butylamino)-2-pyrazinyl]-5-benzimidazolyl]-4-(4-methyl-1-piperazinyl)-2-butynamide IUPAC Name: N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-(4-methylpiperazin-1-yl)but-2-ynamide Traditional Name: N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-(4-methylpiperazino)but-2-ynamide Formula: C24H30N8O MolecularWeight: 446.548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=CN=C1)N2C=NC3=C2C=C(C=C3)NC(=O)C#CCN4CCN(CC4)C

Isomeric SMILES

CC(C)(C)NC1=NC(=CN=C1)N2C=NC3=C2C=C(C=C3)NC(=O)C#CCN4CCN(CC4)C

InChI

InChI=1S/C24H30N8O/c1-24(2,3)29-21-15-25-16-22(28-21)32-17-26-19-8-7-18(14-20(19)32)27-23(33)6-5-9-31-12-10-30(4)11-13-31/h7-8,14-17H,9-13H2,1-4H3,(H,27,33)(H,28,29)