(2-bromanyl-6-methoxy-4-morpholin-4-ylcarbothioyl-phenyl) 4-chloranylbenzoate

Systemtic Name: (2-bromanyl-6-methoxy-4-morpholin-4-ylcarbothioyl-phenyl) 4-chloranylbenzoate Openeye Name: [2-bromo-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-bromo-6-methoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-bromo-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C19H17BrClNO4S MolecularWeight: 470.76458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrClNO4S/c1-24-16-11-13(18(27)22-6-8-25-9-7-22)10-15(20)17(16)26-19(23)12-2-4-14(21)5-3-12/h2-5,10-11H,6-9H2,1H3