6-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-3,3-dimethyl-2,4-dihydrothiochromene 1,1-dioxide

Systemtic Name: 6-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-3,3-dimethyl-2,4-dihydrothiochromene 1,1-dioxide Openeye Name: 6-[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrrol-2-yl]-3,3-dimethyl-2,4-dihydrothiochromene 1,1-dioxide CAS Name: 6-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-3,3-dimethyl-2,4-dihydro-1-benzothiopyran 1,1-dioxide IUPAC Name: 6-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-3,3-dimethyl-2,4-dihydrothiochromene 1,1-dioxide Traditional Name: 6-[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrrol-2-yl]-3,3-dimethyl-2,4-dihydrothiochromene 1,1-dioxide Formula: C26H23FN2O2S MolecularWeight: 446.536423

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2)C3=CC(=C(N3)C4=CC=C(C=C4)F)C5=CC=NC=C5)S(=O)(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=CC(=C2)C3=CC(=C(N3)C4=CC=C(C=C4)F)C5=CC=NC=C5)S(=O)(=O)C1)C

InChI

InChI=1S/C26H23FN2O2S/c1-26(2)15-20-13-19(5-8-24(20)32(30,31)16-26)23-14-22(17-9-11-28-12-10-17)25(29-23)18-3-6-21(27)7-4-18/h3-14,29H,15-16H2,1-2H3