4-(6-phenylazanylpyrimidin-4-yl)-N-(phenylmethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-(6-phenylazanylpyrimidin-4-yl)-N-(phenylmethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-(6-anilinopyrimidin-4-yl)-N-benzyl-1H-pyrrole-2-carboxamide CAS Name: 4-(6-anilino-4-pyrimidinyl)-N-(phenylmethyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-(6-anilinopyrimidin-4-yl)-N-benzyl-1H-pyrrole-2-carboxamide Traditional Name: 4-(6-anilinopyrimidin-4-yl)-N-benzyl-1H-pyrrole-2-carboxamide Formula: C22H19N5O MolecularWeight: 369.41916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC(=CN2)C3=CC(=NC=N3)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC(=CN2)C3=CC(=NC=N3)NC4=CC=CC=C4

InChI

InChI=1S/C22H19N5O/c28-22(24-13-16-7-3-1-4-8-16)20-11-17(14-23-20)19-12-21(26-15-25-19)27-18-9-5-2-6-10-18/h1-12,14-15,23H,13H2,(H,24,28)(H,25,26,27)