S-[[3-(furan-3-ylmethyl)spiro[5.5]undecan-9-yl]methyl] ethanethioate

Systemtic Name: S-[[3-(furan-3-ylmethyl)spiro[5.5]undecan-9-yl]methyl] ethanethioate Openeye Name: S-[[3-(3-furylmethyl)spiro[5.5]undecan-9-yl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[3-(3-furanylmethyl)-9-spiro[5.5]undecanyl]methyl] ester IUPAC Name: S-[[3-(furan-3-ylmethyl)spiro[5.5]undecan-9-yl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[[3-(3-furfuryl)spiro[5.5]undecan-9-yl]methyl] ester Formula: C19H28O2S MolecularWeight: 320.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CCC2(CCC(CC2)CC3=COC=C3)CC1

Isomeric SMILES

CC(=O)SCC1CCC2(CCC(CC2)CC3=COC=C3)CC1

InChI

InChI=1S/C19H28O2S/c1-15(20)22-14-17-4-9-19(10-5-17)7-2-16(3-8-19)12-18-6-11-21-13-18/h6,11,13,16-17H,2-5,7-10,12,14H2,1H3