N-[3-[6-[(2-chloranyl-6-methyl-phenyl)amino]pyrazin-2-yl]benzimidazol-5-yl]-3-pyridin-3-yl-prop-2-ynamide

Systemtic Name: N-[3-[6-[(2-chloranyl-6-methyl-phenyl)amino]pyrazin-2-yl]benzimidazol-5-yl]-3-pyridin-3-yl-prop-2-ynamide Openeye Name: N-[3-[6-(2-chloro-6-methyl-anilino)pyrazin-2-yl]benzimidazol-5-yl]-3-(3-pyridyl)prop-2-ynamide CAS Name: N-[3-[6-(2-chloro-6-methylanilino)-2-pyrazinyl]-5-benzimidazolyl]-3-(3-pyridinyl)-2-propynamide IUPAC Name: N-[3-[6-(2-chloro-6-methylanilino)pyrazin-2-yl]benzimidazol-5-yl]-3-pyridin-3-ylprop-2-ynamide Traditional Name: N-[3-[6-(2-chloro-6-methyl-anilino)pyrazin-2-yl]benzimidazol-5-yl]-3-(3-pyridyl)propiolamide Formula: C26H18ClN7O MolecularWeight: 479.92042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC2=NC(=CN=C2)N3C=NC4=C3C=C(C=C4)NC(=O)C#CC5=CN=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC2=NC(=CN=C2)N3C=NC4=C3C=C(C=C4)NC(=O)C#CC5=CN=CC=C5

InChI

InChI=1S/C26H18ClN7O/c1-17-4-2-6-20(27)26(17)33-23-14-29-15-24(32-23)34-16-30-21-9-8-19(12-22(21)34)31-25(35)10-7-18-5-3-11-28-13-18/h2-6,8-9,11-16H,1H3,(H,31,35)(H,32,33)