N-(2-oxidanyl-1-phenyl-ethyl)-4-[6-[(phenylmethyl)amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-(2-oxidanyl-1-phenyl-ethyl)-4-[6-[(phenylmethyl)amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[6-(benzylamino)pyrimidin-4-yl]-N-(2-hydroxy-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide CAS Name: N-(2-hydroxy-1-phenylethyl)-4-[6-[(phenylmethyl)amino]-4-pyrimidinyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[6-(benzylamino)pyrimidin-4-yl]-N-(2-hydroxy-1-phenylethyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-[6-(benzylamino)pyrimidin-4-yl]-N-(2-hydroxy-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide Formula: C24H23N5O2 MolecularWeight: 413.47172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=NC(=C2)C3=CNC(=C3)C(=O)NC(CO)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=NC(=C2)C3=CNC(=C3)C(=O)NC(CO)C4=CC=CC=C4

InChI

InChI=1S/C24H23N5O2/c30-15-22(18-9-5-2-6-10-18)29-24(31)21-11-19(14-25-21)20-12-23(28-16-27-20)26-13-17-7-3-1-4-8-17/h1-12,14,16,22,25,30H,13,15H2,(H,29,31)(H,26,27,28)