1,2-bis(3-methylphenyl)-1-(3-sulfanylcyclopentyl)ethane-1,2-diol

Systemtic Name: 1,2-bis(3-methylphenyl)-1-(3-sulfanylcyclopentyl)ethane-1,2-diol Openeye Name: 1,2-bis(m-tolyl)-1-(3-sulfanylcyclopentyl)ethane-1,2-diol CAS Name: 1-(3-mercaptocyclopentyl)-1,2-bis(3-methylphenyl)ethane-1,2-diol IUPAC Name: 1,2-bis(3-methylphenyl)-1-(3-sulfanylcyclopentyl)ethane-1,2-diol Traditional Name: 1-(3-mercaptocyclopentyl)-1,2-bis(m-tolyl)ethane-1,2-diol Formula: C21H26O2S MolecularWeight: 342.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C(C2CCC(C2)S)(C3=CC=CC(=C3)C)O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C(C2CCC(C2)S)(C3=CC=CC(=C3)C)O)O

InChI

InChI=1S/C21H26O2S/c1-14-5-3-7-16(11-14)20(22)21(23,18-9-10-19(24)13-18)17-8-4-6-15(2)12-17/h3-8,11-12,18-20,22-24H,9-10,13H2,1-2H3