N-[(2-bromophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-methyl-pyridine-3-carboxamide

Systemtic Name: N-[(2-bromophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-methyl-pyridine-3-carboxamide Openeye Name: N-[(2-bromophenyl)methyl]-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-methyl-pyridine-3-carboxamide CAS Name: N-[(2-bromophenyl)methyl]-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-methyl-3-pyridinecarboxamide IUPAC Name: N-[(2-bromophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-methylpyridine-3-carboxamide Traditional Name: N-(2-bromobenzyl)-2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-methyl-nicotinamide Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)N(C)CC3=CC=CC=C3Br

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)N(C)CC3=CC=CC=C3Br

InChI

InChI=1S/C20H20BrN3O2S/c1-13-17(14(2)26-23-13)12-27-19-16(8-6-10-22-19)20(25)24(3)11-15-7-4-5-9-18(15)21/h4-10H,11-12H2,1-3H3