6-ethoxy-4-[(4-methoxyphenyl)methylsulfanyl]-1H-isothiochromene

Systemtic Name: 6-ethoxy-4-[(4-methoxyphenyl)methylsulfanyl]-1H-isothiochromene Openeye Name: 6-ethoxy-4-[(4-methoxyphenyl)methylsulfanyl]-1H-isothiochromene CAS Name: 6-ethoxy-4-[(4-methoxyphenyl)methylthio]-1H-2-benzothiopyran IUPAC Name: 6-ethoxy-4-[(4-methoxyphenyl)methylsulfanyl]-1H-isothiochromene Traditional Name: 6-ethoxy-4-(p-anisylthio)-1H-isothiochromene Formula: C19H20O2S2 MolecularWeight: 344.4909

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(CSC=C2SCC3=CC=C(C=C3)OC)C=C1

Isomeric SMILES

CCOC1=CC2=C(CSC=C2SCC3=CC=C(C=C3)OC)C=C1

InChI

InChI=1S/C19H20O2S2/c1-3-21-17-9-6-15-12-22-13-19(18(15)10-17)23-11-14-4-7-16(20-2)8-5-14/h4-10,13H,3,11-12H2,1-2H3