N-(4-bromanyl-2-methyl-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(4-bromo-2-methylphenyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(4-bromo-2-methylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-3-pyrrolidinosulfonyl-benzamide Formula: C18H19BrN2O3S MolecularWeight: 423.32406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN2O3S/c1-13-11-15(19)7-8-17(13)20-18(22)14-5-4-6-16(12-14)25(23,24)21-9-2-3-10-21/h4-8,11-12H,2-3,9-10H2,1H3,(H,20,22)