4-(2,2-diethoxyethylsulfanyl)pyrene

Systemtic Name: 4-(2,2-diethoxyethylsulfanyl)pyrene Openeye Name: 4-(2,2-diethoxyethylsulfanyl)pyrene CAS Name: 4-(2,2-diethoxyethylthio)pyrene IUPAC Name: 4-(2,2-diethoxyethylsulfanyl)pyrene Traditional Name: 4-(2,2-diethoxyethylthio)pyrene Formula: C22H22O2S MolecularWeight: 350.47388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CSC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3)OCC

Isomeric SMILES

CCOC(CSC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3)OCC

InChI

InChI=1S/C22H22O2S/c1-3-23-20(24-4-2)14-25-19-13-17-9-5-7-15-11-12-16-8-6-10-18(19)22(16)21(15)17/h5-13,20H,3-4,14H2,1-2H3