6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(phenylsulfonyl)pyridine-3-carboxamide

Systemtic Name: 6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(phenylsulfonyl)pyridine-3-carboxamide Openeye Name: N-(benzenesulfonyl)-6-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]pyridine-3-carboxamide CAS Name: N-(benzenesulfonyl)-6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-3-pyridinecarboxamide IUPAC Name: N-(benzenesulfonyl)-6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]pyridine-3-carboxamide Traditional Name: 6-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-besyl-nicotinamide Formula: C28H26BrN3O4S MolecularWeight: 580.49274

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H26BrN3O4S/c1-2-32(19-23-17-24(29)14-15-26(23)36-20-21-9-5-3-6-10-21)27-16-13-22(18-30-27)28(33)31-37(34,35)25-11-7-4-8-12-25/h3-18H,2,19-20H2,1H3,(H,31,33)