methyl 5-[[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-phenyl]carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-phenyl]carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzoyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[[4-[(4-methyl-2-thiazolyl)thio]-3-nitrophenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzoyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzoyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C18H14N2O7S2 MolecularWeight: 434.44296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)OCC3=CC=C(O3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)OCC3=CC=C(O3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O7S2/c1-10-9-28-18(19-10)29-15-6-3-11(7-13(15)20(23)24)16(21)26-8-12-4-5-14(27-12)17(22)25-2/h3-7,9H,8H2,1-2H3