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

Systemtic Name: N-(4-bromanyl-3-chloranyl-phenyl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-bromo-3-chloro-phenyl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(4-bromo-3-chlorophenyl)-4-methyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(4-bromo-3-chlorophenyl)-4-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-bromo-3-chloro-phenyl)-4-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C18H18BrClN2O3S MolecularWeight: 457.76912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrClN2O3S/c1-12-4-5-13(10-17(12)26(24,25)22-8-2-3-9-22)18(23)21-14-6-7-15(19)16(20)11-14/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,23)