3-chloranyl-6-fluoranyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-fluoranyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-fluoro-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-6-fluoro-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-fluoro-N-(2-methyl-4-pyrrolidin-1-ylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-fluoro-N-(2-methyl-4-pyrrolidino-phenyl)benzothiophene-2-carboxamide Formula: C20H18ClFN2OS MolecularWeight: 388.886123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

InChI

InChI=1S/C20H18ClFN2OS/c1-12-10-14(24-8-2-3-9-24)5-7-16(12)23-20(25)19-18(21)15-6-4-13(22)11-17(15)26-19/h4-7,10-11H,2-3,8-9H2,1H3,(H,23,25)