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methyl 2-acetamido-3-[2-[(phenylmethyl)amino]ethylsulfanyl]propanoate
methyl 2-acetamido-3-[2-[(phenylmethyl)amino]ethylsulfanyl]propanoate
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)NC(CSCCNCC1=CC=CC=C1)C(=O)OC
Isomeric SMILES
CC(=O)NC(CSCCNCC1=CC=CC=C1)C(=O)OC
InChI
InChI=1S/C15H22N2O3S/c1-12(18)17-14(15(19)20-2)11-21-9-8-16-10-13-6-4-3-5-7-13/h3-7,14,16H,8-11H2,1-2H3,(H,17,18)
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