N-(2-bromanyl-4-methyl-phenyl)-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-(2-bromo-4-methylphenyl)-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-methyl-5-morpholinosulfonyl-benzamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C)Br

InChI

InChI=1S/C19H21BrN2O4S/c1-13-3-6-18(17(20)11-13)21-19(23)16-12-15(5-4-14(16)2)27(24,25)22-7-9-26-10-8-22/h3-6,11-12H,7-10H2,1-2H3,(H,21,23)