6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyridine-3-carboxamide

Systemtic Name: 6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyridine-3-carboxamide Openeye Name: 6-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]-N-(3,5-dimethylisoxazol-4-yl)sulfonyl-pyridine-3-carboxamide CAS Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-3-pyridinecarboxamide IUPAC Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyridine-3-carboxamide Traditional Name: 6-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-(3,5-dimethylisoxazol-4-yl)sulfonyl-nicotinamide Formula: C27H27BrN4O5S MolecularWeight: 599.49608

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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=C(ON=C4C)C

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NS(=O)(=O)C4=C(ON=C4C)C

InChI

InChI=1S/C27H27BrN4O5S/c1-4-32(16-22-14-23(28)11-12-24(22)36-17-20-8-6-5-7-9-20)25-13-10-21(15-29-25)27(33)31-38(34,35)26-18(2)30-37-19(26)3/h5-15H,4,16-17H2,1-3H3,(H,31,33)