1-benzothiophen-3-yl-[4-(2-bromoethyloxy)-2-(2-fluoranyl-3-methoxy-phenyl)-6-methyl-phenyl]methanone

Systemtic Name: 1-benzothiophen-3-yl-[4-(2-bromoethyloxy)-2-(2-fluoranyl-3-methoxy-phenyl)-6-methyl-phenyl]methanone Openeye Name: benzothiophen-3-yl-[4-(2-bromoethoxy)-2-(2-fluoro-3-methoxy-phenyl)-6-methyl-phenyl]methanone CAS Name: 1-benzothiophen-3-yl-[4-(2-bromoethoxy)-2-(2-fluoro-3-methoxyphenyl)-6-methylphenyl]methanone IUPAC Name: 1-benzothiophen-3-yl-[4-(2-bromoethoxy)-2-(2-fluoro-3-methoxyphenyl)-6-methylphenyl]methanone Traditional Name: benzothiophen-3-yl-[4-(2-bromoethoxy)-2-(2-fluoro-3-methoxy-phenyl)-6-methyl-phenyl]methanone Formula: C25H20BrFO3S MolecularWeight: 499.391903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)OCCBr)C2=C(C(=CC=C2)OC)F)C(=O)C3=CSC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=CC(=C1)OCCBr)C2=C(C(=CC=C2)OC)F)C(=O)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C25H20BrFO3S/c1-15-12-16(30-11-10-26)13-19(18-7-5-8-21(29-2)24(18)27)23(15)25(28)20-14-31-22-9-4-3-6-17(20)22/h3-9,12-14H,10-11H2,1-2H3