methyl 2-[[2-(2,5-dimethylphenyl)sulfanylpyridin-3-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[2-(2,5-dimethylphenyl)sulfanylpyridin-3-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[2-(2,5-dimethylphenyl)sulfanylpyridine-3-carbonyl]amino]acetate CAS Name: 2-[[[2-[(2,5-dimethylphenyl)thio]-3-pyridinyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(2,5-dimethylphenyl)sulfanylpyridine-3-carbonyl]amino]acetate Traditional Name: 2-[[2-[(2,5-dimethylphenyl)thio]nicotinoyl]amino]acetic acid methyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)NCC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)NCC(=O)OC

InChI

InChI=1S/C17H18N2O3S/c1-11-6-7-12(2)14(9-11)23-17-13(5-4-8-18-17)16(21)19-10-15(20)22-3/h4-9H,10H2,1-3H3,(H,19,21)