tert-butyl 2-[5-[[1-[(2-cyanophenyl)methyl]indol-3-yl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[5-[[1-[(2-cyanophenyl)methyl]indol-3-yl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethanoate Openeye Name: tert-butyl 2-[5-[[1-[(2-cyanophenyl)methyl]indol-3-yl]methylene]-2,4-dioxo-thiazolidin-3-yl]acetate CAS Name: 2-[5-[[1-[(2-cyanophenyl)methyl]-3-indolyl]methylidene]-2,4-dioxo-3-thiazolidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-[[1-[(2-cyanophenyl)methyl]indol-3-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[5-[[1-(2-cyanobenzyl)indol-3-yl]methylene]-2,4-diketo-thiazolidin-3-yl]acetic acid tert-butyl ester Formula: C26H23N3O4S MolecularWeight: 473.54352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4C#N)SC1=O

Isomeric SMILES

CC(C)(C)OC(=O)CN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4C#N)SC1=O

InChI

InChI=1S/C26H23N3O4S/c1-26(2,3)33-23(30)16-29-24(31)22(34-25(29)32)12-19-15-28(21-11-7-6-10-20(19)21)14-18-9-5-4-8-17(18)13-27/h4-12,15H,14,16H2,1-3H3