methyl 3-(3-benzamidopyridin-4-yl)sulfanylpropanoate

Systemtic Name: methyl 3-(3-benzamidopyridin-4-yl)sulfanylpropanoate Openeye Name: methyl 3-[(3-benzamido-4-pyridyl)sulfanyl]propanoate CAS Name: 3-[(3-benzamido-4-pyridinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(3-benzamidopyridin-4-yl)sulfanylpropanoate Traditional Name: 3-[(3-benzamido-4-pyridyl)thio]propionic acid methyl ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=C(C=NC=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CCSC1=C(C=NC=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H16N2O3S/c1-21-15(19)8-10-22-14-7-9-17-11-13(14)18-16(20)12-5-3-2-4-6-12/h2-7,9,11H,8,10H2,1H3,(H,18,20)