N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromanyl-benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromanyl-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-bromobenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromobenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-benzamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H21BrN2O3S/c20-16-7-5-6-15(14-16)19(23)21-17-8-10-18(11-9-17)26(24,25)22-12-3-1-2-4-13-22/h5-11,14H,1-4,12-13H2,(H,21,23)