2-ethyl-4-(2-hydroxyethyloxymethyl)-3-phenylsulfanyl-5-sulfanylidene-cyclohex-2-en-1-one

Systemtic Name: 2-ethyl-4-(2-hydroxyethyloxymethyl)-3-phenylsulfanyl-5-sulfanylidene-cyclohex-2-en-1-one Openeye Name: 2-ethyl-4-(2-hydroxyethoxymethyl)-3-phenylsulfanyl-5-thioxo-cyclohex-2-en-1-one CAS Name: 2-ethyl-4-(2-hydroxyethoxymethyl)-3-(phenylthio)-5-sulfanylidene-1-cyclohex-2-enone IUPAC Name: 2-ethyl-4-(2-hydroxyethoxymethyl)-3-phenylsulfanyl-5-sulfanylidenecyclohex-2-en-1-one Traditional Name: 2-ethyl-4-(2-hydroxyethoxymethyl)-3-(phenylthio)-5-thioxo-cyclohex-2-en-1-one Formula: C17H20O3S2 MolecularWeight: 336.4689

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=S)CC1=O)COCCO)SC2=CC=CC=C2

Isomeric SMILES

CCC1=C(C(C(=S)CC1=O)COCCO)SC2=CC=CC=C2

InChI

InChI=1S/C17H20O3S2/c1-2-13-15(19)10-16(21)14(11-20-9-8-18)17(13)22-12-6-4-3-5-7-12/h3-7,14,18H,2,8-11H2,1H3