2-[methylsulfonyl-(4-phenoxyphenyl)amino]-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 2-[methylsulfonyl-(4-phenoxyphenyl)amino]-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 2-(N-methylsulfonyl-4-phenoxy-anilino)-N-[[4-(1-piperidylmethyl)phenyl]methyl]propanamide CAS Name: 2-(N-methylsulfonyl-4-phenoxyanilino)-N-[[4-(1-piperidinylmethyl)phenyl]methyl]propanamide IUPAC Name: 2-(N-methylsulfonyl-4-phenoxyanilino)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)-N-[4-(piperidinomethyl)benzyl]propionamide Formula: C29H35N3O4S MolecularWeight: 521.6709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)CN2CCCCC2)N(C3=CC=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)CN2CCCCC2)N(C3=CC=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C29H35N3O4S/c1-23(29(33)30-21-24-11-13-25(14-12-24)22-31-19-7-4-8-20-31)32(37(2,34)35)26-15-17-28(18-16-26)36-27-9-5-3-6-10-27/h3,5-6,9-18,23H,4,7-8,19-22H2,1-2H3,(H,30,33)