[2,3-bis(4-ethyloctyl)phenyl]methanethiol

Systemtic Name: [2,3-bis(4-ethyloctyl)phenyl]methanethiol Openeye Name: [2,3-bis(4-ethyloctyl)phenyl]methanethiol CAS Name: [2,3-bis(4-ethyloctyl)phenyl]methanethiol IUPAC Name: [2,3-bis(4-ethyloctyl)phenyl]methanethiol Traditional Name: [2,3-bis(4-ethyloctyl)phenyl]methanethiol Formula: C27H48S MolecularWeight: 404.73502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CCCC1=C(C(=CC=C1)CS)CCCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)CCCC1=C(C(=CC=C1)CS)CCCC(CC)CCCC

InChI

InChI=1S/C27H48S/c1-5-9-14-23(7-3)16-11-18-25-19-13-20-26(22-28)27(25)21-12-17-24(8-4)15-10-6-2/h13,19-20,23-24,28H,5-12,14-18,21-22H2,1-4H3