2-[(4-bromophenyl)methyl-(phenylsulfonyl)amino]-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)methyl-(phenylsulfonyl)amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[benzenesulfonyl-[(4-bromophenyl)methyl]amino]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[benzenesulfonyl-[(4-bromophenyl)methyl]amino]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[benzenesulfonyl-[(4-bromophenyl)methyl]amino]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[besyl-(4-bromobenzyl)amino]-N-(4-pyridylmethyl)acetamide Formula: C21H20BrN3O3S MolecularWeight: 474.3708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Br)CC(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Br)CC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C21H20BrN3O3S/c22-19-8-6-18(7-9-19)15-25(29(27,28)20-4-2-1-3-5-20)16-21(26)24-14-17-10-12-23-13-11-17/h1-13H,14-16H2,(H,24,26)