N-(cyanomethyl)-4-[2-(1H-indazol-5-ylamino)pyrimidin-4-yl]benzamide

Systemtic Name: N-(cyanomethyl)-4-[2-(1H-indazol-5-ylamino)pyrimidin-4-yl]benzamide Openeye Name: N-(cyanomethyl)-4-[2-(1H-indazol-5-ylamino)pyrimidin-4-yl]benzamide CAS Name: N-(cyanomethyl)-4-[2-(1H-indazol-5-ylamino)-4-pyrimidinyl]benzamide IUPAC Name: N-(cyanomethyl)-4-[2-(1H-indazol-5-ylamino)pyrimidin-4-yl]benzamide Traditional Name: N-(cyanomethyl)-4-[2-(1H-indazol-5-ylamino)pyrimidin-4-yl]benzamide Formula: C20H15N7O MolecularWeight: 369.3794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NC=C2)NC3=CC4=C(C=C3)NN=C4)C(=O)NCC#N

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NC=C2)NC3=CC4=C(C=C3)NN=C4)C(=O)NCC#N

InChI

InChI=1S/C20H15N7O/c21-8-10-22-19(28)14-3-1-13(2-4-14)17-7-9-23-20(26-17)25-16-5-6-18-15(11-16)12-24-27-18/h1-7,9,11-12H,10H2,(H,22,28)(H,24,27)(H,23,25,26)