methyl 3,5-bis(4-chlorophenyl)-6-(4-chlorophenyl)carbonyl-thiomorpholine-2-carboxylate

Systemtic Name: methyl 3,5-bis(4-chlorophenyl)-6-(4-chlorophenyl)carbonyl-thiomorpholine-2-carboxylate Openeye Name: methyl 6-(4-chlorobenzoyl)-3,5-bis(4-chlorophenyl)thiomorpholine-2-carboxylate CAS Name: 3,5-bis(4-chlorophenyl)-6-[(4-chlorophenyl)-oxomethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-chlorobenzoyl)-3,5-bis(4-chlorophenyl)thiomorpholine-2-carboxylate Traditional Name: 6-(4-chlorobenzoyl)-3,5-bis(4-chlorophenyl)thiomorpholine-2-carboxylic acid methyl ester Formula: C25H20Cl3NO3S MolecularWeight: 520.8552

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(NC(C(S1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1C(NC(C(S1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H20Cl3NO3S/c1-32-25(31)24-21(15-4-10-18(27)11-5-15)29-20(14-2-8-17(26)9-3-14)23(33-24)22(30)16-6-12-19(28)13-7-16/h2-13,20-21,23-24,29H,1H3