2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[(4-piperidin-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[(4-piperidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-[[4-(1-piperidyl)phenyl]methyl]acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[[4-(1-piperidinyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-(4-piperidinobenzyl)acetamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=C(C=C1)N2CCCCC2)C3=CC=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=C(C=C1)N2CCCCC2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H26BrN3O3S/c1-29(27,28)25(20-11-7-18(22)8-12-20)16-21(26)23-15-17-5-9-19(10-6-17)24-13-3-2-4-14-24/h5-12H,2-4,13-16H2,1H3,(H,23,26)