methyl 2-[[(3E)-3-(5,5-dimethyl-4-morpholin-4-yl-furan-2-ylidene)-2-oxidanylidene-1H-indol-6-yl]sulfanyl]benzoate

Systemtic Name: methyl 2-[[(3E)-3-(5,5-dimethyl-4-morpholin-4-yl-furan-2-ylidene)-2-oxidanylidene-1H-indol-6-yl]sulfanyl]benzoate Openeye Name: methyl 2-[(3E)-3-(5,5-dimethyl-4-morpholino-2-furylidene)-2-oxo-indolin-6-yl]sulfanylbenzoate CAS Name: 2-[[(3E)-3-[5,5-dimethyl-4-(4-morpholinyl)-2-furanylidene]-2-oxo-1H-indol-6-yl]thio]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3E)-3-(5,5-dimethyl-4-morpholin-4-ylfuran-2-ylidene)-2-oxo-1H-indol-6-yl]sulfanyl]benzoate Traditional Name: 2-[[(3E)-3-(5,5-dimethyl-4-morpholino-2-furylidene)-2-keto-indolin-6-yl]thio]benzoic acid methyl ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CC(=C2C3=C(C=C(C=C3)SC4=CC=CC=C4C(=O)OC)NC2=O)O1)N5CCOCC5)C

Isomeric SMILES

CC1(C(=C/C(=C\2/C3=C(C=C(C=C3)SC4=CC=CC=C4C(=O)OC)NC2=O)/O1)N5CCOCC5)C

InChI

InChI=1S/C26H26N2O5S/c1-26(2)22(28-10-12-32-13-11-28)15-20(33-26)23-17-9-8-16(14-19(17)27-24(23)29)34-21-7-5-4-6-18(21)25(30)31-3/h4-9,14-15H,10-13H2,1-3H3,(H,27,29)/b23-20+