2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-anilino)-N-[[4-(morpholinomethyl)phenyl]methyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[[4-(4-morpholinylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(N-mesyl-2-methyl-anilino)-N-[4-(morpholinomethyl)benzyl]acetamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NCC2=CC=C(C=C2)CN3CCOCC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NCC2=CC=C(C=C2)CN3CCOCC3)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O4S/c1-18-5-3-4-6-21(18)25(30(2,27)28)17-22(26)23-15-19-7-9-20(10-8-19)16-24-11-13-29-14-12-24/h3-10H,11-17H2,1-2H3,(H,23,26)