2-[(4-cyclopentyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4-cyclopentyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-cyclopentyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]acetic acid CAS Name: 2-[[4-cyclopentyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[(4-cyclopentyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-cyclopentyl-5-morpholino-1,2,4-triazol-3-yl)thio]acetic acid Formula: C13H20N4O3S MolecularWeight: 312.3879

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=C2SCC(=O)O)N3CCOCC3

Isomeric SMILES

C1CCC(C1)N2C(=NN=C2SCC(=O)O)N3CCOCC3

InChI

InChI=1S/C13H20N4O3S/c18-11(19)9-21-13-15-14-12(16-5-7-20-8-6-16)17(13)10-3-1-2-4-10/h10H,1-9H2,(H,18,19)