[2,6-bis(bromanyl)-4-morpholin-4-ylcarbothioyl-phenyl] 4-chloranylbenzoate

Systemtic Name: [2,6-bis(bromanyl)-4-morpholin-4-ylcarbothioyl-phenyl] 4-chloranylbenzoate Openeye Name: [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2,6-dibromo-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C18H14Br2ClNO3S MolecularWeight: 519.63466

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)C2=CC(=C(C(=C2)Br)OC(=O)C3=CC=C(C=C3)Cl)Br

Isomeric SMILES

C1COCCN1C(=S)C2=CC(=C(C(=C2)Br)OC(=O)C3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C18H14Br2ClNO3S/c19-14-9-12(17(26)22-5-7-24-8-6-22)10-15(20)16(14)25-18(23)11-1-3-13(21)4-2-11/h1-4,9-10H,5-8H2