(2-bromanyl-6-methoxy-4-morpholin-4-ylcarbothioyl-phenyl) naphthalene-2-carboxylate

Systemtic Name: (2-bromanyl-6-methoxy-4-morpholin-4-ylcarbothioyl-phenyl) naphthalene-2-carboxylate Openeye Name: [2-bromo-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] naphthalene-2-carboxylate CAS Name: 2-naphthalenecarboxylic acid [2-bromo-6-methoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] naphthalene-2-carboxylate Traditional Name: naphthalene-2-carboxylic acid [2-bromo-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C23H20BrNO4S MolecularWeight: 486.3782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Br)OC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Br)OC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H20BrNO4S/c1-27-20-14-18(22(30)25-8-10-28-11-9-25)13-19(24)21(20)29-23(26)17-7-6-15-4-2-3-5-16(15)12-17/h2-7,12-14H,8-11H2,1H3