3-phenylsulfanyl-4-(2-pyridin-4-ylethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide

Systemtic Name: 3-phenylsulfanyl-4-(2-pyridin-4-ylethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide Openeye Name: 3-phenylsulfanyl-4-[2-(4-pyridyl)ethoxy]-2,3-dihydrobenzothiophene 1,1-dioxide CAS Name: 3-(phenylthio)-4-(2-pyridin-4-ylethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide IUPAC Name: 3-phenylsulfanyl-4-(2-pyridin-4-ylethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide Traditional Name: 3-(phenylthio)-4-[2-(4-pyridyl)ethoxy]-2,3-dihydrobenzothiophene 1,1-dioxide Formula: C21H19NO3S2 MolecularWeight: 397.51046

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC=C2S1(=O)=O)OCCC3=CC=NC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1C(C2=C(C=CC=C2S1(=O)=O)OCCC3=CC=NC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C21H19NO3S2/c23-27(24)15-19(26-17-5-2-1-3-6-17)21-18(7-4-8-20(21)27)25-14-11-16-9-12-22-13-10-16/h1-10,12-13,19H,11,14-15H2