2-[4-methyl-2-(3-phenylpropylsulfanyl)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-methyl-2-(3-phenylpropylsulfanyl)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-methyl-2-(3-phenylpropylsulfanyl)thiazol-5-yl]acetic acid CAS Name: 2-[4-methyl-2-(3-phenylpropylthio)-5-thiazolyl]acetic acid IUPAC Name: 2-[4-methyl-2-(3-phenylpropylsulfanyl)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-methyl-2-(3-phenylpropylthio)thiazol-5-yl]acetic acid Formula: C15H17NO2S2 MolecularWeight: 307.43098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCCCC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCCCC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C15H17NO2S2/c1-11-13(10-14(17)18)20-15(16-11)19-9-5-8-12-6-3-2-4-7-12/h2-4,6-7H,5,8-10H2,1H3,(H,17,18)