(3-morpholin-4-ylphenyl) 4-(thiomorpholin-4-ylcarbothioylsulfanylmethyl)benzoate

Systemtic Name: (3-morpholin-4-ylphenyl) 4-(thiomorpholin-4-ylcarbothioylsulfanylmethyl)benzoate Openeye Name: (3-morpholinophenyl) 4-(thiomorpholine-4-carbothioylsulfanylmethyl)benzoate CAS Name: 4-[[[sulfanylidene(thiomorpholin-4-yl)methyl]thio]methyl]benzoic acid [3-(4-morpholinyl)phenyl] ester IUPAC Name: (3-morpholin-4-ylphenyl) 4-(thiomorpholine-4-carbothioylsulfanylmethyl)benzoate Traditional Name: 4-[(thiomorpholine-4-carbothioylthio)methyl]benzoic acid (3-morpholinophenyl) ester Formula: C23H26N2O3S3 MolecularWeight: 474.65914

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)CSC(=S)N4CCSCC4

Isomeric SMILES

C1COCCN1C2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)CSC(=S)N4CCSCC4

InChI

InChI=1S/C23H26N2O3S3/c26-22(28-21-3-1-2-20(16-21)24-8-12-27-13-9-24)19-6-4-18(5-7-19)17-31-23(29)25-10-14-30-15-11-25/h1-7,16H,8-15,17H2