2-[1-oxidanylidene-1-(pentylamino)propan-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-oxidanylidene-1-(pentylamino)propan-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-methyl-2-oxo-2-(pentylamino)ethyl]sulfanylacetic acid CAS Name: 2-[[1-oxo-1-(pentylamino)propan-2-yl]thio]acetic acid IUPAC Name: 2-[1-oxo-1-(pentylamino)propan-2-yl]sulfanylacetic acid Traditional Name: 2-[[2-(amylamino)-2-keto-1-methyl-ethyl]thio]acetic acid Formula: C10H19NO3S MolecularWeight: 233.32776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C)SCC(=O)O

Isomeric SMILES

CCCCCNC(=O)C(C)SCC(=O)O

InChI

InChI=1S/C10H19NO3S/c1-3-4-5-6-11-10(14)8(2)15-7-9(12)13/h8H,3-7H2,1-2H3,(H,11,14)(H,12,13)