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

Systemtic Name: phenacyl 2-[1-(1H-indol-6-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpyridine-3-carboxylate Openeye Name: phenacyl 2-[1-(1H-indol-6-yl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[1-(1H-indol-6-yl)-2,5-dioxo-3-pyrrolidinyl]thio]-3-pyridinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-[1-(1H-indol-6-yl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[1-(1H-indol-6-yl)-2,5-diketo-pyrrolidin-3-yl]thio]nicotinic acid phenacyl ester Formula: C26H19N3O5S MolecularWeight: 485.51116

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC3=C(C=C2)C=CN3)SC4=C(C=CC=N4)C(=O)OCC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC3=C(C=C2)C=CN3)SC4=C(C=CC=N4)C(=O)OCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H19N3O5S/c30-21(17-5-2-1-3-6-17)15-34-26(33)19-7-4-11-28-24(19)35-22-14-23(31)29(25(22)32)18-9-8-16-10-12-27-20(16)13-18/h1-13,22,27H,14-15H2