phenylsulfanylbenzene hydrate

Systemtic Name: phenylsulfanylbenzene hydrate Openeye Name: phenylsulfanylbenzene hydrate CAS Name: (phenylthio)benzene hydrate IUPAC Name: phenylsulfanylbenzene hydrate Traditional Name: (phenylthio)benzene hydrate Formula: C24H22OS2 MolecularWeight: 390.56088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2.C1=CC=C(C=C1)SC2=CC=CC=C2.O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2.C1=CC=C(C=C1)SC2=CC=CC=C2.O

InChI

InChI=1S/2C12H10S.H2O/c2*1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h2*1-10H;1H2