methyl 1-[2-(2-aminophenyl)sulfanylethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(2-aminophenyl)sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(2-aminophenyl)sulfanylacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(2-aminophenyl)thio]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2-aminophenyl)sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(2-aminophenyl)thio]acetyl]isonipecotic acid methyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSC2=CC=CC=C2N

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSC2=CC=CC=C2N

InChI

InChI=1S/C15H20N2O3S/c1-20-15(19)11-6-8-17(9-7-11)14(18)10-21-13-5-3-2-4-12(13)16/h2-5,11H,6-10,16H2,1H3