2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C21H26ClN3O6S2 MolecularWeight: 516.03064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O6S2/c1-15(25(32(3,27)28)17-8-11-20(31-2)19(22)14-17)21(26)23-16-6-9-18(10-7-16)33(29,30)24-12-4-5-13-24/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,23,26)