bis[2-(oxan-4-yloxy)phenyl]methanethiol

Systemtic Name: bis[2-(oxan-4-yloxy)phenyl]methanethiol Openeye Name: bis(2-tetrahydropyran-4-yloxyphenyl)methanethiol CAS Name: bis[2-(4-oxanyloxy)phenyl]methanethiol IUPAC Name: bis[2-(oxan-4-yloxy)phenyl]methanethiol Traditional Name: bis(2-tetrahydropyran-4-yloxyphenyl)methanethiol Formula: C23H28O4S MolecularWeight: 400.53102

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC2=CC=CC=C2C(C3=CC=CC=C3OC4CCOCC4)S

Isomeric SMILES

C1COCCC1OC2=CC=CC=C2C(C3=CC=CC=C3OC4CCOCC4)S

InChI

InChI=1S/C23H28O4S/c28-23(19-5-1-3-7-21(19)26-17-9-13-24-14-10-17)20-6-2-4-8-22(20)27-18-11-15-25-16-12-18/h1-8,17-18,23,28H,9-16H2