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3-methylbutyl 3-phenylsulfanyl-1H-indole-2-carboxylate

3-methylbutyl 3-phenylsulfanyl-1H-indole-2-carboxylate

Systemtic Name:3-methylbutyl 3-phenylsulfanyl-1H-indole-2-carboxylate
Openeye Name:isopentyl 3-phenylsulfanyl-1H-indole-2-carboxylate
CAS Name:3-(phenylthio)-1H-indole-2-carboxylic acid 3-methylbutyl ester
IUPAC Name:3-methylbutyl 3-phenylsulfanyl-1H-indole-2-carboxylate
Traditional Name:3-(phenylthio)-1H-indole-2-carboxylic acid isoamyl ester
Formula: C20H21NO2S
MolecularWeight: 339.45124
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=C(C2=CC=CC=C2N1)SC3=CC=CC=C3


Isomeric SMILES

CC(C)CCOC(=O)C1=C(C2=CC=CC=C2N1)SC3=CC=CC=C3


InChI

InChI=1S/C20H21NO2S/c1-14(2)12-13-23-20(22)18-19(24-15-8-4-3-5-9-15)16-10-6-7-11-17(16)21-18/h3-11,14,21H,12-13H2,1-2H3


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