N-(4-bromanyl-3-methyl-phenyl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(4-bromo-3-methylphenyl)-4-methyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)Br)C)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)Br)C)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H21BrN2O3S/c1-13-5-6-15(12-18(13)26(24,25)22-9-3-4-10-22)19(23)21-16-7-8-17(20)14(2)11-16/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,23)