5-oxidanyl-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]pyran-4-one

Systemtic Name: 5-oxidanyl-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]pyran-4-one Openeye Name: 5-hydroxy-2-[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]pyran-4-one CAS Name: 5-hydroxy-2-[[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-4-pyranone IUPAC Name: 5-hydroxy-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]pyran-4-one Traditional Name: 5-hydroxy-2-[[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]pyran-4-one Formula: C11H13N3O3S2 MolecularWeight: 299.36922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NN=C(S1)SCC2=CC(=O)C(=CO2)O

Isomeric SMILES

CC(C)NC1=NN=C(S1)SCC2=CC(=O)C(=CO2)O

InChI

InChI=1S/C11H13N3O3S2/c1-6(2)12-10-13-14-11(19-10)18-5-7-3-8(15)9(16)4-17-7/h3-4,6,16H,5H2,1-2H3,(H,12,13)