2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-[(2-morpholin-4-ylpyridin-3-yl)methyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-[(2-morpholin-4-ylpyridin-3-yl)methyl]ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenyl)sulfanyl-N-[(2-morpholino-3-pyridyl)methyl]acetamide CAS Name: 2-[(4-bromo-2-methylphenyl)thio]-N-[[2-(4-morpholinyl)-3-pyridinyl]methyl]acetamide IUPAC Name: 2-(4-bromo-2-methylphenyl)sulfanyl-N-[(2-morpholin-4-ylpyridin-3-yl)methyl]acetamide Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]-N-[(2-morpholino-3-pyridyl)methyl]acetamide Formula: C19H22BrN3O2S MolecularWeight: 436.36588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)NCC2=C(N=CC=C2)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)NCC2=C(N=CC=C2)N3CCOCC3

InChI

InChI=1S/C19H22BrN3O2S/c1-14-11-16(20)4-5-17(14)26-13-18(24)22-12-15-3-2-6-21-19(15)23-7-9-25-10-8-23/h2-6,11H,7-10,12-13H2,1H3,(H,22,24)