N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromanyl-2-(3-methylbutoxy)benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromanyl-2-(3-methylbutoxy)benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromo-2-isopentyloxy-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-5-bromo-2-(3-methylbutoxy)benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromo-2-(3-methylbutoxy)benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromo-2-isoamoxy-benzamide Formula: C24H31BrN2O4S MolecularWeight: 523.48294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H31BrN2O4S/c1-18(2)13-16-31-23-12-7-19(25)17-22(23)24(28)26-20-8-10-21(11-9-20)32(29,30)27-14-5-3-4-6-15-27/h7-12,17-18H,3-6,13-16H2,1-2H3,(H,26,28)