2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]propanamide

Systemtic Name: 2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]propanamide Openeye Name: 2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[(4-morpholinophenyl)methyl]propanamide CAS Name: 2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[[4-(4-morpholinyl)phenyl]methyl]propanamide IUPAC Name: 2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide Traditional Name: 2-(5-chloro-N-mesyl-2-methyl-anilino)-N-(4-morpholinobenzyl)propionamide Formula: C22H28ClN3O4S MolecularWeight: 465.99342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)NCC2=CC=C(C=C2)N3CCOCC3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)NCC2=CC=C(C=C2)N3CCOCC3)S(=O)(=O)C

InChI

InChI=1S/C22H28ClN3O4S/c1-16-4-7-19(23)14-21(16)26(31(3,28)29)17(2)22(27)24-15-18-5-8-20(9-6-18)25-10-12-30-13-11-25/h4-9,14,17H,10-13,15H2,1-3H3,(H,24,27)