(phenylmethyl) 2-[[4-methyl-2-(sulfanylmethyl)pentanoyl]amino]propanoate

Systemtic Name: (phenylmethyl) 2-[[4-methyl-2-(sulfanylmethyl)pentanoyl]amino]propanoate Openeye Name: benzyl 2-[[4-methyl-2-(sulfanylmethyl)pentanoyl]amino]propanoate CAS Name: 2-[[2-(mercaptomethyl)-4-methyl-1-oxopentyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[4-methyl-2-(sulfanylmethyl)pentanoyl]amino]propanoate Traditional Name: 2-[[2-(mercaptomethyl)-4-methyl-pentanoyl]amino]propionic acid benzyl ester Formula: C17H25NO3S MolecularWeight: 323.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CS)C(=O)NC(C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(CS)C(=O)NC(C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H25NO3S/c1-12(2)9-15(11-22)16(19)18-13(3)17(20)21-10-14-7-5-4-6-8-14/h4-8,12-13,15,22H,9-11H2,1-3H3,(H,18,19)