4-[5-(hydroxymethyl)-2-(1-oxidanylbutan-2-yl)pyrimidin-4-yl]-N-[(1S)-2-oxidanyl-1-phenyl-ethyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[5-(hydroxymethyl)-2-(1-oxidanylbutan-2-yl)pyrimidin-4-yl]-N-[(1S)-2-oxidanyl-1-phenyl-ethyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[5-(hydroxymethyl)-2-[1-(hydroxymethyl)propyl]pyrimidin-4-yl]-N-[(1S)-2-hydroxy-1-phenyl-ethyl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-(1-hydroxybutan-2-yl)-5-(hydroxymethyl)-4-pyrimidinyl]-N-[(1S)-2-hydroxy-1-phenylethyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-(1-hydroxybutan-2-yl)-5-(hydroxymethyl)pyrimidin-4-yl]-N-[(1S)-2-hydroxy-1-phenylethyl]-1H-pyrrole-2-carboxamide Traditional Name: N-[(1S)-2-hydroxy-1-phenyl-ethyl]-4-[5-methylol-2-(1-methylolpropyl)pyrimidin-4-yl]-1H-pyrrole-2-carboxamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)C1=NC=C(C(=N1)C2=CNC(=C2)C(=O)NC(CO)C3=CC=CC=C3)CO

Isomeric SMILES

CCC(CO)C1=NC=C(C(=N1)C2=CNC(=C2)C(=O)N[C@H](CO)C3=CC=CC=C3)CO

InChI

InChI=1S/C22H26N4O4/c1-2-14(11-27)21-24-10-17(12-28)20(26-21)16-8-18(23-9-16)22(30)25-19(13-29)15-6-4-3-5-7-15/h3-10,14,19,23,27-29H,2,11-13H2,1H3,(H,25,30)/t14?,19-/m1/s1