methyl 2-acetamido-6-[4-oxidanylidene-2-(1H-pyrrol-2-yl)-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: methyl 2-acetamido-6-[4-oxidanylidene-2-(1H-pyrrol-2-yl)-1,3-thiazolidin-3-yl]hexanoate Openeye Name: methyl 2-acetamido-6-[4-oxo-2-(1H-pyrrol-2-yl)thiazolidin-3-yl]hexanoate CAS Name: 2-acetamido-6-[4-oxo-2-(1H-pyrrol-2-yl)-3-thiazolidinyl]hexanoic acid methyl ester IUPAC Name: methyl 2-acetamido-6-[4-oxo-2-(1H-pyrrol-2-yl)-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 2-acetamido-6-[4-keto-2-(1H-pyrrol-2-yl)thiazolidin-3-yl]hexanoic acid methyl ester Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCN1C(SCC1=O)C2=CC=CN2)C(=O)OC

Isomeric SMILES

CC(=O)NC(CCCCN1C(SCC1=O)C2=CC=CN2)C(=O)OC

InChI

InChI=1S/C16H23N3O4S/c1-11(20)18-13(16(22)23-2)6-3-4-9-19-14(21)10-24-15(19)12-7-5-8-17-12/h5,7-8,13,15,17H,3-4,6,9-10H2,1-2H3,(H,18,20)