1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-3-phenethyl-thiourea

Systemtic Name: 1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-3-phenethyl-thiourea Openeye Name: 1-phenethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]thiourea CAS Name: 1-phenethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]thiourea IUPAC Name: 1-phenethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]thiourea Traditional Name: 1-phenethyl-3-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)thiourea Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NC2C(C(C(C(O2)CO)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NC2C(C(C(C(O2)CO)O)O)O

InChI

InChI=1S/C15H22N2O5S/c18-8-10-11(19)12(20)13(21)14(22-10)17-15(23)16-7-6-9-4-2-1-3-5-9/h1-5,10-14,18-21H,6-8H2,(H2,16,17,23)