1-(4-fluorophenyl)-3-[[4-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methyl]thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-[[4-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methyl]thiourea Openeye Name: 1-(4-fluorophenyl)-3-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyl]thiourea CAS Name: 1-(4-fluorophenyl)-3-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methyl]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl]thiourea Traditional Name: 1-(4-fluorophenyl)-3-[(5-hydroxy-6-methyl-4-methylol-3-pyridyl)methyl]thiourea Formula: C15H16FN3O2S MolecularWeight: 321.369843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CO)CNC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

CC1=NC=C(C(=C1O)CO)CNC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C15H16FN3O2S/c1-9-14(21)13(8-20)10(6-17-9)7-18-15(22)19-12-4-2-11(16)3-5-12/h2-6,20-21H,7-8H2,1H3,(H2,18,19,22)