1-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]cyclopentane-1-carboxylic acid Openeye Name: 1-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]cyclopentanecarboxylic acid CAS Name: 1-[[1-oxo-5-(7H-purin-6-ylthio)pentyl]amino]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]cyclopentane-1-carboxylic acid Traditional Name: 1-[5-(7H-purin-6-ylthio)pentanoylamino]cyclopentanecarboxylic acid Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)O)NC(=O)CCCCSC2=NC=NC3=C2NC=N3

Isomeric SMILES

C1CCC(C1)(C(=O)O)NC(=O)CCCCSC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C16H21N5O3S/c22-11(21-16(15(23)24)6-2-3-7-16)5-1-4-8-25-14-12-13(18-9-17-12)19-10-20-14/h9-10H,1-8H2,(H,21,22)(H,23,24)(H,17,18,19,20)