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2-methyl-1-propanoyl-3-sulfanyl-3H-indole-2-carboxylic acid

2-methyl-1-propanoyl-3-sulfanyl-3H-indole-2-carboxylic acid

Systemtic Name:2-methyl-1-propanoyl-3-sulfanyl-3H-indole-2-carboxylic acid
Openeye Name:2-methyl-1-propanoyl-3-sulfanyl-indoline-2-carboxylic acid
CAS Name:3-mercapto-2-methyl-1-(1-oxopropyl)-3H-indole-2-carboxylic acid
IUPAC Name:2-methyl-1-propanoyl-3-sulfanyl-3H-indole-2-carboxylic acid
Traditional Name:3-mercapto-2-methyl-1-propionyl-indoline-2-carboxylic acid
Formula: C13H15NO3S
MolecularWeight: 265.3281
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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C2=CC=CC=C2C(C1(C)C(=O)O)S


Isomeric SMILES

CCC(=O)N1C2=CC=CC=C2C(C1(C)C(=O)O)S


InChI

InChI=1S/C13H15NO3S/c1-3-10(15)14-9-7-5-4-6-8(9)11(18)13(14,2)12(16)17/h4-7,11,18H,3H2,1-2H3,(H,16,17)


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