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methylbenzene; phenylsulfonylmethanethiol

methylbenzene; phenylsulfonylmethanethiol

Systemtic Name:methylbenzene; phenylsulfonylmethanethiol
Openeye Name:benzenesulfonylmethanethiol; toluene
CAS Name:benzenesulfonylmethanethiol; toluene
IUPAC Name:benzenesulfonylmethanethiol; toluene
Traditional Name:besylmethanethiol; toluene
Formula: C14H16O2S2
MolecularWeight: 280.40564
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.C1=CC=C(C=C1)S(=O)(=O)CS


Isomeric SMILES

CC1=CC=CC=C1.C1=CC=C(C=C1)S(=O)(=O)CS


InChI

InChI=1S/C7H8O2S2.C7H8/c8-11(9,6-10)7-4-2-1-3-5-7;1-7-5-3-2-4-6-7/h1-5,10H,6H2;2-6H,1H3


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