(4-cyanophenyl)methyl 2-morpholin-4-ylcarbothioylsulfanylethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-morpholin-4-ylcarbothioylsulfanylethanoate Openeye Name: (4-cyanophenyl)methyl 2-(morpholine-4-carbothioylsulfanyl)acetate CAS Name: 2-[[4-morpholinyl(sulfanylidene)methyl]thio]acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-(morpholine-4-carbothioylsulfanyl)acetate Traditional Name: 2-(morpholine-4-carbothioylthio)acetic acid (4-cyanobenzyl) ester Formula: C15H16N2O3S2 MolecularWeight: 336.42914

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)SCC(=O)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

C1COCCN1C(=S)SCC(=O)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H16N2O3S2/c16-9-12-1-3-13(4-2-12)10-20-14(18)11-22-15(21)17-5-7-19-8-6-17/h1-4H,5-8,10-11H2