N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-4,6-dimethyl-1H-indole-2-carboxamide

Systemtic Name: N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-4,6-dimethyl-1H-indole-2-carboxamide Openeye Name: N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-4,6-dimethyl-1H-indole-2-carboxamide CAS Name: N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-4,6-dimethyl-1H-indole-2-carboxamide IUPAC Name: N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4,6-dimethyl-1H-indole-2-carboxamide Traditional Name: N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-4,6-dimethyl-1H-indole-2-carboxamide Formula: C20H20ClFN2OS MolecularWeight: 390.902003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC2=C1)C(=O)NCCSCC3=C(C=CC=C3Cl)F)C

Isomeric SMILES

CC1=CC(=C2C=C(NC2=C1)C(=O)NCCSCC3=C(C=CC=C3Cl)F)C

InChI

InChI=1S/C20H20ClFN2OS/c1-12-8-13(2)14-10-19(24-18(14)9-12)20(25)23-6-7-26-11-15-16(21)4-3-5-17(15)22/h3-5,8-10,24H,6-7,11H2,1-2H3,(H,23,25)