4-chloranyl-5-(phenylazanylmethyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide

Systemtic Name: 4-chloranyl-5-(phenylazanylmethyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide Openeye Name: 5-(anilinomethyl)-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide CAS Name: 5-(anilinomethyl)-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide IUPAC Name: 5-(anilinomethyl)-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide Traditional Name: 5-(anilinomethyl)-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide Formula: C14H12ClN5O MolecularWeight: 301.73098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCC2=CNC3=C2C(=NC(=N3)C(=O)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)NCC2=CNC3=C2C(=NC(=N3)C(=O)N)Cl

InChI

InChI=1S/C14H12ClN5O/c15-11-10-8(6-17-9-4-2-1-3-5-9)7-18-13(10)20-14(19-11)12(16)21/h1-5,7,17H,6H2,(H2,16,21)(H,18,19,20)