N-(cyanomethyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide

Systemtic Name: N-(cyanomethyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide Openeye Name: N-(cyanomethyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide CAS Name: N-(cyanomethyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide IUPAC Name: N-(cyanomethyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide Traditional Name: N-(cyanomethyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide Formula: C13H10N6O MolecularWeight: 266.2581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC2=NC=NC(=C21)C3=CNC(=C3)C(=O)NCC#N

Isomeric SMILES

C1=CNC2=NC=NC(=C21)C3=CNC(=C3)C(=O)NCC#N

InChI

InChI=1S/C13H10N6O/c14-2-4-16-13(20)10-5-8(6-17-10)11-9-1-3-15-12(9)19-7-18-11/h1,3,5-7,17H,4H2,(H,16,20)(H,15,18,19)