2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]-N-(4-methyl-3-morpholinosulfonyl-phenyl)propanamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)-methyl-amino]-N-(4-methyl-3-morpholinosulfonyl-phenyl)propionamide Formula: C22H27ClFN3O4S MolecularWeight: 483.983883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)N(C)CC2=C(C=CC=C2Cl)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)N(C)CC2=C(C=CC=C2Cl)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H27ClFN3O4S/c1-15-7-8-17(13-21(15)32(29,30)27-9-11-31-12-10-27)25-22(28)16(2)26(3)14-18-19(23)5-4-6-20(18)24/h4-8,13,16H,9-12,14H2,1-3H3,(H,25,28)