[5-(2-chloranyl-4-fluoranyl-phenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol

Systemtic Name: [5-(2-chloranyl-4-fluoranyl-phenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Openeye Name: [5-(2-chloro-4-fluoro-phenyl)sulfanyl-4-isopropyl-2-methyl-1-(4-pyridylmethyl)pyrrol-3-yl]methanol CAS Name: [5-[(2-chloro-4-fluorophenyl)thio]-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-3-pyrrolyl]methanol IUPAC Name: [5-(2-chloro-4-fluorophenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Traditional Name: [5-[(2-chloro-4-fluoro-phenyl)thio]-4-isopropyl-2-methyl-1-(4-pyridylmethyl)pyrrol-3-yl]methanol Formula: C21H22ClFN2OS MolecularWeight: 404.928583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=C(C=C(C=C3)F)Cl)C(C)C)CO

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=C(C=C(C=C3)F)Cl)C(C)C)CO

InChI

InChI=1S/C21H22ClFN2OS/c1-13(2)20-17(12-26)14(3)25(11-15-6-8-24-9-7-15)21(20)27-19-5-4-16(23)10-18(19)22/h4-10,13,26H,11-12H2,1-3H3