S-[(3Z)-3-[[3-[5-[[tert-butyl(dimethyl)silyl]oxyamino]-5-oxidanylidene-pentyl]-1,2,3-triazol-4-yl]methylidene]-1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl] ethanethioate

Systemtic Name: S-[(3Z)-3-[[3-[5-[[tert-butyl(dimethyl)silyl]oxyamino]-5-oxidanylidene-pentyl]-1,2,3-triazol-4-yl]methylidene]-1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl] ethanethioate Openeye Name: S-[(3Z)-3-[[3-[5-[[tert-butyl(dimethyl)silyl]oxyamino]-5-oxo-pentyl]triazol-4-yl]methylene]-1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxo-ethyl]-4-piperidyl] ethanethioate CAS Name: ethanethioic acid S-[(3Z)-3-[[3-[5-[[tert-butyl(dimethyl)silyl]oxyamino]-5-oxopentyl]-4-triazolyl]methylidene]-1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4-piperidinyl] ester IUPAC Name: S-[(3Z)-3-[[3-[5-[[tert-butyl(dimethyl)silyl]oxyamino]-5-oxopentyl]triazol-4-yl]methylidene]-1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]piperidin-4-yl] ethanethioate Traditional Name: ethanethioic acid S-[(3Z)-3-[[3-[5-[[tert-butyl(dimethyl)silyl]oxyamino]-5-keto-pentyl]triazol-4-yl]methylene]-1-[2-cyclopropyl-1-(2-fluorophenyl)-2-keto-ethyl]-4-piperidyl] ester Formula: C32H46FN5O4SSi MolecularWeight: 643.887643

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CCN(CC1=CC2=CN=NN2CCCCC(=O)NO[Si](C)(C)C(C)(C)C)C(C3=CC=CC=C3F)C(=O)C4CC4

Isomeric SMILES

CC(=O)SC\1CCN(C/C1=C/C2=CN=NN2CCCCC(=O)NO[Si](C)(C)C(C)(C)C)C(C3=CC=CC=C3F)C(=O)C4CC4

InChI

InChI=1S/C32H46FN5O4SSi/c1-22(39)43-28-16-18-37(30(31(41)23-14-15-23)26-11-7-8-12-27(26)33)21-24(28)19-25-20-34-36-38(25)17-10-9-13-29(40)35-42-44(5,6)32(2,3)4/h7-8,11-12,19-20,23,28,30H,9-10,13-18,21H2,1-6H3,(H,35,40)/b24-19-