2-[(2-acetamido-3-oxidanylidene-3-piperazin-1-yl-propyl)sulfanylmethyl]-3-oxidanylidene-cyclopentane-1-carboxylic acid

Systemtic Name: 2-[(2-acetamido-3-oxidanylidene-3-piperazin-1-yl-propyl)sulfanylmethyl]-3-oxidanylidene-cyclopentane-1-carboxylic acid Openeye Name: 2-[(2-acetamido-3-oxo-3-piperazin-1-yl-propyl)sulfanylmethyl]-3-oxo-cyclopentanecarboxylic acid CAS Name: 2-[[[2-acetamido-3-oxo-3-(1-piperazinyl)propyl]thio]methyl]-3-oxo-1-cyclopentanecarboxylic acid IUPAC Name: 2-[(2-acetamido-3-oxo-3-piperazin-1-ylpropyl)sulfanylmethyl]-3-oxocyclopentane-1-carboxylic acid Traditional Name: 2-[[(2-acetamido-3-keto-3-piperazino-propyl)thio]methyl]-3-keto-cyclopentanecarboxylic acid Formula: C16H25N3O5S MolecularWeight: 371.4518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSCC1C(CCC1=O)C(=O)O)C(=O)N2CCNCC2

Isomeric SMILES

CC(=O)NC(CSCC1C(CCC1=O)C(=O)O)C(=O)N2CCNCC2

InChI

InChI=1S/C16H25N3O5S/c1-10(20)18-13(15(22)19-6-4-17-5-7-19)9-25-8-12-11(16(23)24)2-3-14(12)21/h11-13,17H,2-9H2,1H3,(H,18,20)(H,23,24)