phenacyl 2-[1-(1H-indol-6-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylbenzoate

Systemtic Name: phenacyl 2-[1-(1H-indol-6-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylbenzoate Openeye Name: phenacyl 2-[1-(1H-indol-6-yl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylbenzoate CAS Name: 2-[[1-(1H-indol-6-yl)-2,5-dioxo-3-pyrrolidinyl]thio]benzoic acid phenacyl ester IUPAC Name: phenacyl 2-[1-(1H-indol-6-yl)-2,5-dioxopyrrolidin-3-yl]sulfanylbenzoate Traditional Name: 2-[[1-(1H-indol-6-yl)-2,5-diketo-pyrrolidin-3-yl]thio]benzoic acid phenacyl ester Formula: C27H20N2O5S MolecularWeight: 484.5231

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC3=C(C=C2)C=CN3)SC4=CC=CC=C4C(=O)OCC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC3=C(C=C2)C=CN3)SC4=CC=CC=C4C(=O)OCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H20N2O5S/c30-22(18-6-2-1-3-7-18)16-34-27(33)20-8-4-5-9-23(20)35-24-15-25(31)29(26(24)32)19-11-10-17-12-13-28-21(17)14-19/h1-14,24,28H,15-16H2