1-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-5-(phenylmethoxycarbonylcarbamothioylamino)imidazole-4-carboxylic acid

Systemtic Name: 1-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-5-(phenylmethoxycarbonylcarbamothioylamino)imidazole-4-carboxylic acid Openeye Name: 5-(benzyloxycarbonylcarbamothioylamino)-1-[3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]imidazole-4-carboxylic acid CAS Name: 1-[3,4-diacetyloxy-5-(acetyloxymethyl)-2-oxolanyl]-5-[[phenylmethoxycarbonylamino(sulfanylidene)methyl]amino]-4-imidazolecarboxylic acid IUPAC Name: 1-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-5-(phenylmethoxycarbonylcarbamothioylamino)imidazole-4-carboxylic acid Traditional Name: 5-(carbobenzoxythiocarbamoylamino)-1-[3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]imidazole-4-carboxylic acid Formula: C24H26N4O11S MolecularWeight: 578.54844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC(=C2NC(=S)NC(=O)OCC3=CC=CC=C3)C(=O)O)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(O1)N2C=NC(=C2NC(=S)NC(=O)OCC3=CC=CC=C3)C(=O)O)OC(=O)C)OC(=O)C

InChI

InChI=1S/C24H26N4O11S/c1-12(29)35-10-16-18(37-13(2)30)19(38-14(3)31)21(39-16)28-11-25-17(22(32)33)20(28)26-23(40)27-24(34)36-9-15-7-5-4-6-8-15/h4-8,11,16,18-19,21H,9-10H2,1-3H3,(H,32,33)(H2,26,27,34,40)