diethyl 3-(2-piperidin-1-ylcarbonylphenyl)sulfanylbenzene-1,2-dicarboxylate

Systemtic Name: diethyl 3-(2-piperidin-1-ylcarbonylphenyl)sulfanylbenzene-1,2-dicarboxylate Openeye Name: diethyl 3-[2-(piperidine-1-carbonyl)phenyl]sulfanylbenzene-1,2-dicarboxylate CAS Name: 3-[[2-[oxo(1-piperidinyl)methyl]phenyl]thio]benzene-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-[2-(piperidine-1-carbonyl)phenyl]sulfanylbenzene-1,2-dicarboxylate Traditional Name: 3-[[2-(piperidine-1-carbonyl)phenyl]thio]benzene-1,2-dicarboxylic acid diethyl ester Formula: C24H27NO5S MolecularWeight: 441.53988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)SC2=CC=CC=C2C(=O)N3CCCCC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)SC2=CC=CC=C2C(=O)N3CCCCC3)C(=O)OCC

InChI

InChI=1S/C24H27NO5S/c1-3-29-23(27)18-12-10-14-20(21(18)24(28)30-4-2)31-19-13-7-6-11-17(19)22(26)25-15-8-5-9-16-25/h6-7,10-14H,3-5,8-9,15-16H2,1-2H3