methyl 3-(morpholin-4-ylcarbothioylsulfanylmethyl)benzoate

Systemtic Name: methyl 3-(morpholin-4-ylcarbothioylsulfanylmethyl)benzoate Openeye Name: methyl 3-(morpholine-4-carbothioylsulfanylmethyl)benzoate CAS Name: 3-[[[4-morpholinyl(sulfanylidene)methyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-(morpholine-4-carbothioylsulfanylmethyl)benzoate Traditional Name: 3-[(morpholine-4-carbothioylthio)methyl]benzoic acid methyl ester Formula: C14H17NO3S2 MolecularWeight: 311.41968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSC(=S)N2CCOCC2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSC(=S)N2CCOCC2

InChI

InChI=1S/C14H17NO3S2/c1-17-13(16)12-4-2-3-11(9-12)10-20-14(19)15-5-7-18-8-6-15/h2-4,9H,5-8,10H2,1H3