4-[(2-bromanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]-2-chloranyl-benzamide

Systemtic Name: 4-[(2-bromanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]-2-chloranyl-benzamide Openeye Name: 4-[(2-bromo-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]-2-chloro-benzamide CAS Name: 4-[[[2-bromo-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]-2-chlorobenzamide IUPAC Name: 4-[(2-bromo-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]-2-chlorobenzamide Traditional Name: 4-[(2-bromo-5-pyrrolidinosulfonyl-benzoyl)amino]-2-chloro-benzamide Formula: C18H17BrClN3O4S MolecularWeight: 486.76728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NC3=CC(=C(C=C3)C(=O)N)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NC3=CC(=C(C=C3)C(=O)N)Cl

InChI

InChI=1S/C18H17BrClN3O4S/c19-15-6-4-12(28(26,27)23-7-1-2-8-23)10-14(15)18(25)22-11-3-5-13(17(21)24)16(20)9-11/h3-6,9-10H,1-2,7-8H2,(H2,21,24)(H,22,25)