N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-3-[N-(p-tolylsulfonyl)anilino]propanamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-3-(N-(4-methylphenyl)sulfonylanilino)propanamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-3-(N-(4-methylphenyl)sulfonylanilino)propanamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-3-(N-tosylanilino)propionamide Formula: C27H31N3O6S2 MolecularWeight: 557.68154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O6S2/c1-21-8-12-25(13-9-21)37(32,33)30(24-6-4-3-5-7-24)15-14-27(31)28-23-11-10-22(2)26(20-23)38(34,35)29-16-18-36-19-17-29/h3-13,20H,14-19H2,1-2H3,(H,28,31)