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

Systemtic Name: 6-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-2,2-dimethyl-3,4-dihydrothiochromene 1-oxide Openeye Name: 6-[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrrol-2-yl]-2,2-dimethyl-3,4-dihydrothiochromene 1-oxide CAS Name: 6-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-2,2-dimethyl-3,4-dihydro-1-benzothiopyran 1-oxide IUPAC Name: 6-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-2,2-dimethyl-3,4-dihydrothiochromene 1-oxide Traditional Name: 6-[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrrol-2-yl]-2,2-dimethyl-3,4-dihydrothiochromene 1-oxide Formula: C26H23FN2OS MolecularWeight: 430.537023

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(S1=O)C=CC(=C2)C3=CC(=C(N3)C4=CC=C(C=C4)F)C5=CC=NC=C5)C

Isomeric SMILES

CC1(CCC2=C(S1=O)C=CC(=C2)C3=CC(=C(N3)C4=CC=C(C=C4)F)C5=CC=NC=C5)C

InChI

InChI=1S/C26H23FN2OS/c1-26(2)12-9-20-15-19(5-8-24(20)31(26)30)23-16-22(17-10-13-28-14-11-17)25(29-23)18-3-6-21(27)7-4-18/h3-8,10-11,13-16,29H,9,12H2,1-2H3