2-[1,4-dimethyl-5-(1-methyl-5-methylsulfanyl-pyrrol-2-yl)pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[1,4-dimethyl-5-(1-methyl-5-methylsulfanyl-pyrrol-2-yl)pyrrol-2-yl]ethanoic acid Openeye Name: 2-[1,4-dimethyl-5-(1-methyl-5-methylsulfanyl-pyrrol-2-yl)pyrrol-2-yl]acetic acid CAS Name: 2-[1,4-dimethyl-5-[1-methyl-5-(methylthio)-2-pyrrolyl]-2-pyrrolyl]acetic acid IUPAC Name: 2-[1,4-dimethyl-5-(1-methyl-5-methylsulfanylpyrrol-2-yl)pyrrol-2-yl]acetic acid Traditional Name: 2-[1,4-dimethyl-5-[1-methyl-5-(methylthio)pyrrol-2-yl]pyrrol-2-yl]acetic acid Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1)CC(=O)O)C)C2=CC=C(N2C)SC

Isomeric SMILES

CC1=C(N(C(=C1)CC(=O)O)C)C2=CC=C(N2C)SC

InChI

InChI=1S/C14H18N2O2S/c1-9-7-10(8-13(17)18)15(2)14(9)11-5-6-12(19-4)16(11)3/h5-7H,8H2,1-4H3,(H,17,18)