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

Systemtic Name: N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-oxidanyl-but-2-ynamide Openeye Name: N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-hydroxy-but-2-ynamide CAS Name: N-[3-[6-(tert-butylamino)-2-pyrazinyl]-5-benzimidazolyl]-4-hydroxy-2-butynamide IUPAC Name: N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-hydroxybut-2-ynamide Traditional Name: N-[3-[6-(tert-butylamino)pyrazin-2-yl]benzimidazol-5-yl]-4-hydroxy-but-2-ynamide Formula: C19H20N6O2 MolecularWeight: 364.4011

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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#CCO

Isomeric SMILES

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

InChI

InChI=1S/C19H20N6O2/c1-19(2,3)24-16-10-20-11-17(23-16)25-12-21-14-7-6-13(9-15(14)25)22-18(27)5-4-8-26/h6-7,9-12,26H,8H2,1-3H3,(H,22,27)(H,23,24)