S-[2-[2-morpholin-4-ylethyl-(4-phenylphenyl)sulfonyl-amino]propyl] ethanethioate

Systemtic Name: S-[2-[2-morpholin-4-ylethyl-(4-phenylphenyl)sulfonyl-amino]propyl] ethanethioate Openeye Name: S-[2-[2-morpholinoethyl-(4-phenylphenyl)sulfonyl-amino]propyl] ethanethioate CAS Name: ethanethioic acid S-[2-[2-(4-morpholinyl)ethyl-(4-phenylphenyl)sulfonylamino]propyl] ester IUPAC Name: S-[2-[2-morpholin-4-ylethyl-(4-phenylphenyl)sulfonylamino]propyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[2-morpholinoethyl-(4-phenylphenyl)sulfonyl-amino]propyl] ester Formula: C23H30N2O4S2 MolecularWeight: 462.6253

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)N(CCN1CCOCC1)S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(CSC(=O)C)N(CCN1CCOCC1)S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H30N2O4S2/c1-19(18-30-20(2)26)25(13-12-24-14-16-29-17-15-24)31(27,28)23-10-8-22(9-11-23)21-6-4-3-5-7-21/h3-11,19H,12-18H2,1-2H3