2-bromanyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-bromo-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[1-(phenylmethyl)-3-pyrrolidinyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-bromo-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-bromo-5-pyrrolidinosulfonyl-benzamide Formula: C22H26BrN3O3S MolecularWeight: 492.42914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NC3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H26BrN3O3S/c23-21-9-8-19(30(28,29)26-11-4-5-12-26)14-20(21)22(27)24-18-10-13-25(16-18)15-17-6-2-1-3-7-17/h1-3,6-9,14,18H,4-5,10-13,15-16H2,(H,24,27)