4-[[(4-bromanyl-3-methyl-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[(4-bromanyl-3-methyl-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[(4-bromo-3-methyl-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[(4-bromo-3-methylphenyl)sulfonyl-cyclopropylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[(4-bromo-3-methylphenyl)sulfonyl-cyclopropylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[(4-bromo-3-methyl-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-methyl-benzamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC)C3CC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC)C3CC3)Br

InChI

InChI=1S/C19H21BrN2O3S/c1-13-11-17(9-10-18(13)20)26(24,25)22(16-7-8-16)12-14-3-5-15(6-4-14)19(23)21-2/h3-6,9-11,16H,7-8,12H2,1-2H3,(H,21,23)