N-(4-bromanyl-2,6-dimethyl-phenyl)-2-(2-ethoxy-4-morpholin-4-ylcarbothioyl-phenoxy)ethanamide

Systemtic Name: N-(4-bromanyl-2,6-dimethyl-phenyl)-2-(2-ethoxy-4-morpholin-4-ylcarbothioyl-phenoxy)ethanamide Openeye Name: N-(4-bromo-2,6-dimethyl-phenyl)-2-[2-ethoxy-4-(morpholine-4-carbothioyl)phenoxy]acetamide CAS Name: N-(4-bromo-2,6-dimethylphenyl)-2-[2-ethoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenoxy]acetamide IUPAC Name: N-(4-bromo-2,6-dimethylphenyl)-2-[2-ethoxy-4-(morpholine-4-carbothioyl)phenoxy]acetamide Traditional Name: N-(4-bromo-2,6-dimethyl-phenyl)-2-[2-ethoxy-4-(morpholine-4-carbothioyl)phenoxy]acetamide Formula: C23H27BrN2O4S MolecularWeight: 507.44048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=S)N2CCOCC2)OCC(=O)NC3=C(C=C(C=C3C)Br)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=S)N2CCOCC2)OCC(=O)NC3=C(C=C(C=C3C)Br)C

InChI

InChI=1S/C23H27BrN2O4S/c1-4-29-20-13-17(23(31)26-7-9-28-10-8-26)5-6-19(20)30-14-21(27)25-22-15(2)11-18(24)12-16(22)3/h5-6,11-13H,4,7-10,14H2,1-3H3,(H,25,27)