2-[(4-methylphenyl)-methylsulfonyl-amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[(4-methylphenyl)-methylsulfonyl-amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 2-(4-methyl-N-methylsulfonylanilino)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-(N-mesyl-4-methyl-anilino)-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O5S2/c1-16-6-10-19(11-7-16)24(30(3,26)27)17(2)21(25)22-18-8-12-20(13-9-18)31(28,29)23-14-4-5-15-23/h6-13,17H,4-5,14-15H2,1-3H3,(H,22,25)