2-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 2-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 2-(2,5-dichloro-N-methylsulfonyl-anilino)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide CAS Name: 2-(2,5-dichloro-N-methylsulfonylanilino)-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-(2,5-dichloro-N-mesyl-anilino)-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)propionamide Formula: C21H25Cl2N3O6S2 MolecularWeight: 550.4757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OC)N(C3=C(C=CC(=C3)Cl)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OC)N(C3=C(C=CC(=C3)Cl)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H25Cl2N3O6S2/c1-14(26(33(3,28)29)19-12-15(22)6-8-17(19)23)21(27)24-18-13-16(7-9-20(18)32-2)34(30,31)25-10-4-5-11-25/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,24,27)