[(3S)-3-methyl-5-oxidanyl-pentoxy]-phenoxy-methanethione

Systemtic Name: [(3S)-3-methyl-5-oxidanyl-pentoxy]-phenoxy-methanethione Openeye Name: [(3S)-5-hydroxy-3-methyl-pentoxy]-phenoxy-methanethione CAS Name: [(3S)-5-hydroxy-3-methylpentoxy]-phenoxymethanethione IUPAC Name: [(3S)-5-hydroxy-3-methylpentoxy]-phenoxymethanethione Traditional Name: [(3S)-5-hydroxy-3-methyl-pentoxy]-phenoxy-methanethione Formula: C13H18O3S MolecularWeight: 254.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)CCOC(=S)OC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CCO)CCOC(=S)OC1=CC=CC=C1

InChI

InChI=1S/C13H18O3S/c1-11(7-9-14)8-10-15-13(17)16-12-5-3-2-4-6-12/h2-6,11,14H,7-10H2,1H3/t11-/m0/s1