2-chloranyl-N-(3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-(3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-fluoranyl-benzamide Openeye Name: 2-chloro-N-(3-cyano-6-phenyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-fluoro-benzamide CAS Name: 2-chloro-N-(3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-fluorobenzamide IUPAC Name: 2-chloro-N-(3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-fluorobenzamide Traditional Name: 2-chloro-N-(3-cyano-6-phenyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-fluoro-benzamide Formula: C22H16ClFN2OS MolecularWeight: 410.891643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=CC=C3)SC(=C2C#N)NC(=O)C4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CC2=C(CC1C3=CC=CC=C3)SC(=C2C#N)NC(=O)C4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C22H16ClFN2OS/c23-19-11-15(24)7-9-17(19)21(27)26-22-18(12-25)16-8-6-14(10-20(16)28-22)13-4-2-1-3-5-13/h1-5,7,9,11,14H,6,8,10H2,(H,26,27)