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methyl (2S)-2-acetamido-3-(2-ethylsulfanyl-1H-indol-3-yl)propanoate

methyl (2S)-2-acetamido-3-(2-ethylsulfanyl-1H-indol-3-yl)propanoate

Systemtic Name:methyl (2S)-2-acetamido-3-(2-ethylsulfanyl-1H-indol-3-yl)propanoate
Openeye Name:methyl (2S)-2-acetamido-3-(2-ethylsulfanyl-1H-indol-3-yl)propanoate
CAS Name:(2S)-2-acetamido-3-[2-(ethylthio)-1H-indol-3-yl]propanoic acid methyl ester
IUPAC Name:methyl (2S)-2-acetamido-3-(2-ethylsulfanyl-1H-indol-3-yl)propanoate
Traditional Name:(2S)-2-acetamido-3-[2-(ethylthio)-1H-indol-3-yl]propionic acid methyl ester
Formula: C16H20N2O3S
MolecularWeight: 320.4066
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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C2=CC=CC=C2N1)CC(C(=O)OC)NC(=O)C


Isomeric SMILES

CCSC1=C(C2=CC=CC=C2N1)C[C@@H](C(=O)OC)NC(=O)C


InChI

InChI=1S/C16H20N2O3S/c1-4-22-15-12(11-7-5-6-8-13(11)18-15)9-14(16(20)21-3)17-10(2)19/h5-8,14,18H,4,9H2,1-3H3,(H,17,19)/t14-/m0/s1


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