N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-4-(3-thiomorpholin-4-ylpyrazin-2-yl)oxy-benzamide

Systemtic Name: N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-4-(3-thiomorpholin-4-ylpyrazin-2-yl)oxy-benzamide Openeye Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-4-(3-thiomorpholinopyrazin-2-yl)oxy-benzamide CAS Name: N-[(3-chloro-4-fluorophenyl)methyl]-4-[(3-thiomorpholin-4-yl-2-pyrazinyl)oxy]benzamide IUPAC Name: N-[(3-chloro-4-fluorophenyl)methyl]-4-(3-thiomorpholin-4-ylpyrazin-2-yl)oxybenzamide Traditional Name: N-(3-chloro-4-fluoro-benzyl)-4-(3-thiomorpholinopyrazin-2-yl)oxy-benzamide Formula: C22H20ClFN4O2S MolecularWeight: 458.936203

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C2=NC=CN=C2OC3=CC=C(C=C3)C(=O)NCC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CSCCN1C2=NC=CN=C2OC3=CC=C(C=C3)C(=O)NCC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H20ClFN4O2S/c23-18-13-15(1-6-19(18)24)14-27-21(29)16-2-4-17(5-3-16)30-22-20(25-7-8-26-22)28-9-11-31-12-10-28/h1-8,13H,9-12,14H2,(H,27,29)