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

Systemtic Name: [2,6-bis(bromanyl)-4-morpholin-4-ylcarbothioyl-phenyl] 4-methoxybenzoate Openeye Name: [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [2,6-dibromo-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C19H17Br2NO4S MolecularWeight: 515.21558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C(=S)N3CCOCC3)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C(=S)N3CCOCC3)Br

InChI

InChI=1S/C19H17Br2NO4S/c1-24-14-4-2-12(3-5-14)19(23)26-17-15(20)10-13(11-16(17)21)18(27)22-6-8-25-9-7-22/h2-5,10-11H,6-9H2,1H3