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2-[2-methyl-1-(4-methylsulfonylphenyl)sulfanyl-indolizin-3-yl]ethanoic acid

2-[2-methyl-1-(4-methylsulfonylphenyl)sulfanyl-indolizin-3-yl]ethanoic acid

Systemtic Name:2-[2-methyl-1-(4-methylsulfonylphenyl)sulfanyl-indolizin-3-yl]ethanoic acid
Openeye Name:2-[2-methyl-1-(4-methylsulfonylphenyl)sulfanyl-indolizin-3-yl]acetic acid
CAS Name:2-[2-methyl-1-[(4-methylsulfonylphenyl)thio]-3-indolizinyl]acetic acid
IUPAC Name:2-[2-methyl-1-(4-methylsulfonylphenyl)sulfanylindolizin-3-yl]acetic acid
Traditional Name:2-[1-[(4-mesylphenyl)thio]-2-methyl-indolizin-3-yl]acetic acid
Formula: C18H17NO4S2
MolecularWeight: 375.46188
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=CC=CC2=C1SC3=CC=C(C=C3)S(=O)(=O)C)CC(=O)O


Isomeric SMILES

CC1=C(N2C=CC=CC2=C1SC3=CC=C(C=C3)S(=O)(=O)C)CC(=O)O


InChI

InChI=1S/C18H17NO4S2/c1-12-16(11-17(20)21)19-10-4-3-5-15(19)18(12)24-13-6-8-14(9-7-13)25(2,22)23/h3-10H,11H2,1-2H3,(H,20,21)


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