[2,6-bis(bromanyl)-4-morpholin-4-ylcarbothioyl-phenyl] naphthalene-1-carboxylate

Systemtic Name: [2,6-bis(bromanyl)-4-morpholin-4-ylcarbothioyl-phenyl] naphthalene-1-carboxylate Openeye Name: [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [2,6-dibromo-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [2,6-dibromo-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C22H17Br2NO3S MolecularWeight: 535.24828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)C2=CC(=C(C(=C2)Br)OC(=O)C3=CC=CC4=CC=CC=C43)Br

Isomeric SMILES

C1COCCN1C(=S)C2=CC(=C(C(=C2)Br)OC(=O)C3=CC=CC4=CC=CC=C43)Br

InChI

InChI=1S/C22H17Br2NO3S/c23-18-12-15(21(29)25-8-10-27-11-9-25)13-19(24)20(18)28-22(26)17-7-3-5-14-4-1-2-6-16(14)17/h1-7,12-13H,8-11H2