4-(5-methyl-2-propylsulfanyl-pyrimidin-4-yl)-N-(2-oxidanyl-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-(5-methyl-2-propylsulfanyl-pyrimidin-4-yl)-N-(2-oxidanyl-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide Openeye Name: N-(2-hydroxy-1-phenyl-ethyl)-4-(5-methyl-2-propylsulfanyl-pyrimidin-4-yl)-1H-pyrrole-2-carboxamide CAS Name: N-(2-hydroxy-1-phenylethyl)-4-[5-methyl-2-(propylthio)-4-pyrimidinyl]-1H-pyrrole-2-carboxamide IUPAC Name: N-(2-hydroxy-1-phenylethyl)-4-(5-methyl-2-propylsulfanylpyrimidin-4-yl)-1H-pyrrole-2-carboxamide Traditional Name: N-(2-hydroxy-1-phenyl-ethyl)-4-[5-methyl-2-(propylthio)pyrimidin-4-yl]-1H-pyrrole-2-carboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C(=N1)C2=CNC(=C2)C(=O)NC(CO)C3=CC=CC=C3)C

Isomeric SMILES

CCCSC1=NC=C(C(=N1)C2=CNC(=C2)C(=O)NC(CO)C3=CC=CC=C3)C

InChI

InChI=1S/C21H24N4O2S/c1-3-9-28-21-23-11-14(2)19(25-21)16-10-17(22-12-16)20(27)24-18(13-26)15-7-5-4-6-8-15/h4-8,10-12,18,22,26H,3,9,13H2,1-2H3,(H,24,27)