2-[4-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-(2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)piperazin-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-(2-chloro-5-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-(2-chloro-5-pyrrolidinosulfonyl-benzoyl)piperazino]-N-cyclopropyl-acetamide Formula: C20H27ClN4O4S MolecularWeight: 454.97078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)CC(=O)NC4CC4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)CC(=O)NC4CC4

InChI

InChI=1S/C20H27ClN4O4S/c21-18-6-5-16(30(28,29)25-7-1-2-8-25)13-17(18)20(27)24-11-9-23(10-12-24)14-19(26)22-15-3-4-15/h5-6,13,15H,1-4,7-12,14H2,(H,22,26)