2-[(3-chloranyl-4-methyl-phenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methyl-phenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]ethanamide Openeye Name: 2-(3-chloro-4-methyl-N-methylsulfonyl-anilino)-N-[(4-morpholinophenyl)methyl]acetamide CAS Name: 2-(3-chloro-4-methyl-N-methylsulfonylanilino)-N-[[4-(4-morpholinyl)phenyl]methyl]acetamide IUPAC Name: 2-(3-chloro-4-methyl-N-methylsulfonylanilino)-N-[(4-morpholin-4-ylphenyl)methyl]acetamide Traditional Name: 2-(3-chloro-N-mesyl-4-methyl-anilino)-N-(4-morpholinobenzyl)acetamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O4S/c1-16-3-6-19(13-20(16)22)25(30(2,27)28)15-21(26)23-14-17-4-7-18(8-5-17)24-9-11-29-12-10-24/h3-8,13H,9-12,14-15H2,1-2H3,(H,23,26)