4-(azepan-1-ylsulfonyl)-N-[4-bromanyl-2-(2-chlorophenyl)carbonyl-phenyl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[4-bromanyl-2-(2-chlorophenyl)carbonyl-phenyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[4-bromo-2-(2-chlorobenzoyl)phenyl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[4-bromo-2-[(2-chlorophenyl)-oxomethyl]phenyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[4-bromo-2-(2-chlorobenzoyl)phenyl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[4-bromo-2-(2-chlorobenzoyl)phenyl]benzamide Formula: C26H24BrClN2O4S MolecularWeight: 575.90176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H24BrClN2O4S/c27-19-11-14-24(22(17-19)25(31)21-7-3-4-8-23(21)28)29-26(32)18-9-12-20(13-10-18)35(33,34)30-15-5-1-2-6-16-30/h3-4,7-14,17H,1-2,5-6,15-16H2,(H,29,32)