N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromanyl-4-(oxolan-2-ylmethoxy)benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromanyl-4-(oxolan-2-ylmethoxy)benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-4-(tetrahydrofuran-2-ylmethoxy)benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-bromo-4-(2-oxolanylmethoxy)benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-4-(oxolan-2-ylmethoxy)benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-4-(tetrahydrofurfuryloxy)benzamide Formula: C24H29BrN2O5S MolecularWeight: 537.46646

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OCC4CCCO4)Br

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OCC4CCCO4)Br

InChI

InChI=1S/C24H29BrN2O5S/c25-22-16-18(7-12-23(22)32-17-20-6-5-15-31-20)24(28)26-19-8-10-21(11-9-19)33(29,30)27-13-3-1-2-4-14-27/h7-12,16,20H,1-6,13-15,17H2,(H,26,28)