N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[(4-chlorophenyl)methylamino]ethanamide; ethanedioic acid

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[(4-chlorophenyl)methylamino]ethanamide; ethanedioic acid Openeye Name: 2-[(4-chlorophenyl)methylamino]-N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)acetamide; oxalic acid CAS Name: 2-[(4-chlorophenyl)methylamino]-N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]acetamide; oxalic acid IUPAC Name: 2-[(4-chlorophenyl)methylamino]-N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)acetamide; oxalic acid Traditional Name: 2-[(4-chlorobenzyl)amino]-N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)acetamide; oxalic acid Formula: C21H23Cl2N3O7S MolecularWeight: 532.39422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CNCC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CNCC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H21Cl2N3O3S.C2H2O4/c20-15-5-3-14(4-6-15)12-22-13-19(25)23-18-11-16(7-8-17(18)21)28(26,27)24-9-1-2-10-24;3-1(4)2(5)6/h3-8,11,22H,1-2,9-10,12-13H2,(H,23,25);(H,3,4)(H,5,6)