S-[[3-(dimethylamino)-3-oxidanylidene-propyl]sulfanyl-phenyl-methyl] ethanethioate

Systemtic Name: S-[[3-(dimethylamino)-3-oxidanylidene-propyl]sulfanyl-phenyl-methyl] ethanethioate Openeye Name: S-[[3-(dimethylamino)-3-oxo-propyl]sulfanyl-phenyl-methyl] ethanethioate CAS Name: ethanethioic acid S-[[[3-(dimethylamino)-3-oxopropyl]thio]-phenylmethyl] ester IUPAC Name: S-[[3-(dimethylamino)-3-oxopropyl]sulfanyl-phenylmethyl] ethanethioate Traditional Name: ethanethioic acid S-[[[3-(dimethylamino)-3-keto-propyl]thio]-phenyl-methyl] ester Formula: C14H19NO2S2 MolecularWeight: 297.43616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(C1=CC=CC=C1)SCCC(=O)N(C)C

Isomeric SMILES

CC(=O)SC(C1=CC=CC=C1)SCCC(=O)N(C)C

InChI

InChI=1S/C14H19NO2S2/c1-11(16)19-14(12-7-5-4-6-8-12)18-10-9-13(17)15(2)3/h4-8,14H,9-10H2,1-3H3