1-[3,5-bis(hydroxymethyl)-4-oxidanyl-phenyl]-1-methyl-3-phenyl-thiourea

Systemtic Name: 1-[3,5-bis(hydroxymethyl)-4-oxidanyl-phenyl]-1-methyl-3-phenyl-thiourea Openeye Name: 1-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]-1-methyl-3-phenyl-thiourea CAS Name: 1-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]-1-methyl-3-phenylthiourea IUPAC Name: 1-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]-1-methyl-3-phenylthiourea Traditional Name: 1-(4-hydroxy-3,5-dimethylol-phenyl)-1-methyl-3-phenyl-thiourea Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=C(C(=C1)CO)O)CO)C(=S)NC2=CC=CC=C2

Isomeric SMILES

CN(C1=CC(=C(C(=C1)CO)O)CO)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O3S/c1-18(16(22)17-13-5-3-2-4-6-13)14-7-11(9-19)15(21)12(8-14)10-20/h2-8,19-21H,9-10H2,1H3,(H,17,22)