(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone

Systemtic Name: (3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone Openeye Name: (3-chloro-6-fluoro-benzothiophen-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone CAS Name: (3-chloro-6-fluoro-1-benzothiophen-2-yl)-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]methanone IUPAC Name: (3-chloro-6-fluoro-1-benzothiophen-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone Traditional Name: (3-chloro-6-fluoro-benzothiophen-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidino]methanone Formula: C21H19ClFNO3S MolecularWeight: 419.896863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2C(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2C(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl)OC

InChI

InChI=1S/C21H19ClFNO3S/c1-26-16-8-5-12(10-17(16)27-2)15-4-3-9-24(15)21(25)20-19(22)14-7-6-13(23)11-18(14)28-20/h5-8,10-11,15H,3-4,9H2,1-2H3