methyl (E)-2-(4-chlorophenyl)-3-piperidin-1-yl-prop-2-enedithioate

Systemtic Name: methyl (E)-2-(4-chlorophenyl)-3-piperidin-1-yl-prop-2-enedithioate Openeye Name: methyl (E)-2-(4-chlorophenyl)-3-(1-piperidyl)prop-2-enedithioate CAS Name: (E)-2-(4-chlorophenyl)-3-(1-piperidinyl)-2-propenedithioic acid methyl ester IUPAC Name: methyl (E)-2-(4-chlorophenyl)-3-piperidin-1-ylprop-2-enedithioate Traditional Name: (E)-2-(4-chlorophenyl)-3-piperidino-prop-2-enedithioic acid methyl ester Formula: C15H18ClNS2 MolecularWeight: 311.89312

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)C(=CN1CCCCC1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CSC(=S)/C(=C/N1CCCCC1)/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClNS2/c1-19-15(18)14(11-17-9-3-2-4-10-17)12-5-7-13(16)8-6-12/h5-8,11H,2-4,9-10H2,1H3/b14-11+