[3-bromanyl-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-morpholin-4-yl-methanethione

Systemtic Name: [3-bromanyl-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-morpholin-4-yl-methanethione Openeye Name: [3-bromo-5-ethoxy-4-(p-tolylmethoxy)phenyl]-morpholino-methanethione CAS Name: [3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-(4-morpholinyl)methanethione IUPAC Name: [3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-morpholin-4-ylmethanethione Traditional Name: [3-bromo-5-ethoxy-4-(4-methylbenzyl)oxy-phenyl]-morpholino-methanethione Formula: C21H24BrNO3S MolecularWeight: 450.38916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Br)OCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Br)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C21H24BrNO3S/c1-3-25-19-13-17(21(27)23-8-10-24-11-9-23)12-18(22)20(19)26-14-16-6-4-15(2)5-7-16/h4-7,12-13H,3,8-11,14H2,1-2H3