1-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-3-(pyridin-2-ylcarbonylamino)thiourea

Systemtic Name: 1-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-3-(pyridin-2-ylcarbonylamino)thiourea Openeye Name: 1-(pyridine-2-carbonylamino)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]thiourea CAS Name: 1-[[oxo(2-pyridinyl)methyl]amino]-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]thiourea IUPAC Name: 1-(pyridine-2-carbonylamino)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]thiourea Traditional Name: 1-picolinamido-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]thiourea Formula: C13H18N4O6S MolecularWeight: 358.37022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)NNC(=S)NC2C(C(C(C(O2)CO)O)O)O

Isomeric SMILES

C1=CC=NC(=C1)C(=O)NNC(=S)N[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O

InChI

InChI=1S/C13H18N4O6S/c18-5-7-8(19)9(20)10(21)12(23-7)15-13(24)17-16-11(22)6-3-1-2-4-14-6/h1-4,7-10,12,18-21H,5H2,(H,16,22)(H2,15,17,24)/t7-,8-,9+,10-,12-/m1/s1