furan-2-ylmethyl 5-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxylate

Systemtic Name: furan-2-ylmethyl 5-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxylate Openeye Name: 2-furylmethyl 5-[2-(2-furylmethylamino)-2-oxo-ethyl]-6-oxo-benzo[b][1,4]benzothiazepine-3-carboxylate CAS Name: 5-[2-(2-furanylmethylamino)-2-oxoethyl]-6-oxo-3-benzo[b][1,4]benzothiazepinecarboxylic acid 2-furanylmethyl ester IUPAC Name: furan-2-ylmethyl 5-[2-(furan-2-ylmethylamino)-2-oxoethyl]-6-oxobenzo[b][1,4]benzothiazepine-3-carboxylate Traditional Name: 5-[2-(2-furfurylamino)-2-keto-ethyl]-6-keto-benzo[b][1,4]benzothiazepine-3-carboxylic acid 2-furfuryl ester Formula: C26H20N2O6S MolecularWeight: 488.5118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C3=C(S2)C=CC(=C3)C(=O)OCC4=CC=CO4)CC(=O)NCC5=CC=CO5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C3=C(S2)C=CC(=C3)C(=O)OCC4=CC=CO4)CC(=O)NCC5=CC=CO5

InChI

InChI=1S/C26H20N2O6S/c29-24(27-14-18-5-3-11-32-18)15-28-21-13-17(26(31)34-16-19-6-4-12-33-19)9-10-23(21)35-22-8-2-1-7-20(22)25(28)30/h1-13H,14-16H2,(H,27,29)