3-bromanyl-5-ethoxy-4-methoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 3-bromanyl-5-ethoxy-4-methoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 3-bromo-5-ethoxy-4-methoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 3-bromo-5-ethoxy-4-methoxy-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 3-bromo-5-ethoxy-4-methoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 3-bromo-5-ethoxy-4-methoxy-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C20H23BrN2O5S MolecularWeight: 483.37602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)Br)OC

InChI

InChI=1S/C20H23BrN2O5S/c1-3-28-18-13-14(12-17(21)19(18)27-2)20(24)22-15-6-8-16(9-7-15)29(25,26)23-10-4-5-11-23/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,22,24)