1-(2-hexylphenyl)sulfanyl-2-methyl-4-octyl-benzene

Systemtic Name: 1-(2-hexylphenyl)sulfanyl-2-methyl-4-octyl-benzene Openeye Name: 1-(2-hexylphenyl)sulfanyl-2-methyl-4-octyl-benzene CAS Name: 1-[(2-hexylphenyl)thio]-2-methyl-4-octylbenzene IUPAC Name: 1-(2-hexylphenyl)sulfanyl-2-methyl-4-octylbenzene Traditional Name: 1-[(2-hexylphenyl)thio]-2-methyl-4-octyl-benzene Formula: C27H40S MolecularWeight: 396.6715

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)SC2=CC=CC=C2CCCCCC)C

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)SC2=CC=CC=C2CCCCCC)C

InChI

InChI=1S/C27H40S/c1-4-6-8-10-11-12-16-24-20-21-26(23(3)22-24)28-27-19-15-14-18-25(27)17-13-9-7-5-2/h14-15,18-22H,4-13,16-17H2,1-3H3