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phenacyl 3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxylate

phenacyl 3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxylate

Systemtic Name:phenacyl 3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxylate
Openeye Name:phenacyl 3-(cyclohexylsulfanylmethyl)benzofuran-2-carboxylate
CAS Name:3-[(cyclohexylthio)methyl]-2-benzofurancarboxylic acid phenacyl ester
IUPAC Name:phenacyl 3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxylate
Traditional Name:3-[(cyclohexylthio)methyl]coumarilic acid phenacyl ester
Formula: C24H24O4S
MolecularWeight: 408.50996
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)OCC(=O)C4=CC=CC=C4


Isomeric SMILES

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)OCC(=O)C4=CC=CC=C4


InChI

InChI=1S/C24H24O4S/c25-21(17-9-3-1-4-10-17)15-27-24(26)23-20(16-29-18-11-5-2-6-12-18)19-13-7-8-14-22(19)28-23/h1,3-4,7-10,13-14,18H,2,5-6,11-12,15-16H2


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