N-(2-imidazol-1-ylethyl)-3-[(5-methylfuran-2-yl)methylamino]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-imidazol-1-ylethyl)-3-[(5-methylfuran-2-yl)methylamino]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-imidazol-1-ylethyl)-3-[(5-methyl-2-furyl)methylamino]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(1-imidazolyl)ethyl]-3-[(5-methyl-2-furanyl)methylamino]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-imidazol-1-ylethyl)-3-[(5-methylfuran-2-yl)methylamino]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2-imidazol-1-ylethyl)-3-[(5-methyl-2-furyl)methylamino]-5-pyrrolidinosulfonyl-benzamide Formula: C22H27N5O4S MolecularWeight: 457.54588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC2=CC(=CC(=C2)C(=O)NCCN3C=CN=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(O1)CNC2=CC(=CC(=C2)C(=O)NCCN3C=CN=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H27N5O4S/c1-17-4-5-20(31-17)15-25-19-12-18(22(28)24-7-11-26-10-6-23-16-26)13-21(14-19)32(29,30)27-8-2-3-9-27/h4-6,10,12-14,16,25H,2-3,7-9,11,15H2,1H3,(H,24,28)