2-bromanyl-N-(4-butylphenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-(4-butylphenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(4-butylphenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-(4-butylphenyl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(4-butylphenyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(4-butylphenyl)-5-pyrrolidinosulfonyl-benzamide Formula: C21H25BrN2O3S MolecularWeight: 465.4038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

InChI

InChI=1S/C21H25BrN2O3S/c1-2-3-6-16-7-9-17(10-8-16)23-21(25)19-15-18(11-12-20(19)22)28(26,27)24-13-4-5-14-24/h7-12,15H,2-6,13-14H2,1H3,(H,23,25)