N-tert-butyl-3-[[3-methyl-2-(2-pyridin-3-yloxyethanoylamino)butanoyl]amino]-2-oxidanyl-3-(4-phenylbutanoyl)-1,3-thiazolidin-3-ium-4-carboxamide

Systemtic Name: N-tert-butyl-3-[[3-methyl-2-(2-pyridin-3-yloxyethanoylamino)butanoyl]amino]-2-oxidanyl-3-(4-phenylbutanoyl)-1,3-thiazolidin-3-ium-4-carboxamide Openeye Name: N-tert-butyl-2-hydroxy-3-[[3-methyl-2-[[2-(3-pyridyloxy)acetyl]amino]butanoyl]amino]-3-(4-phenylbutanoyl)thiazolidin-3-ium-4-carboxamide CAS Name: N-tert-butyl-2-hydroxy-3-[[3-methyl-1-oxo-2-[[1-oxo-2-(3-pyridinyloxy)ethyl]amino]butyl]amino]-3-(1-oxo-4-phenylbutyl)-4-thiazolidin-3-iumcarboxamide IUPAC Name: N-tert-butyl-2-hydroxy-3-[[3-methyl-2-[(2-pyridin-3-yloxyacetyl)amino]butanoyl]amino]-3-(4-phenylbutanoyl)-1,3-thiazolidin-3-ium-4-carboxamide Traditional Name: N-tert-butyl-2-hydroxy-3-[[3-methyl-2-[[2-(3-pyridyloxy)acetyl]amino]butanoyl]amino]-3-(4-phenylbutanoyl)thiazolidin-3-ium-4-carboxamide Formula: C30H42N5O6S+ MolecularWeight: 600.74938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N[N+]1(C(CSC1O)C(=O)NC(C)(C)C)C(=O)CCCC2=CC=CC=C2)NC(=O)COC3=CN=CC=C3

Isomeric SMILES

CC(C)C(C(=O)N[N+]1(C(CSC1O)C(=O)NC(C)(C)C)C(=O)CCCC2=CC=CC=C2)NC(=O)COC3=CN=CC=C3

InChI

InChI=1S/C30H41N5O6S/c1-20(2)26(32-24(36)18-41-22-14-10-16-31-17-22)28(39)34-35(25(37)15-9-13-21-11-7-6-8-12-21)23(19-42-29(35)40)27(38)33-30(3,4)5/h6-8,10-12,14,16-17,20,23,26,29,40H,9,13,15,18-19H2,1-5H3,(H2-,32,33,34,36,38,39)/p+1