3-(4-morpholin-4-ylsulfonylphenyl)-N-[2-(phenylmethylsulfanyl)phenyl]propanamide

Systemtic Name: 3-(4-morpholin-4-ylsulfonylphenyl)-N-[2-(phenylmethylsulfanyl)phenyl]propanamide Openeye Name: N-(2-benzylsulfanylphenyl)-3-(4-morpholinosulfonylphenyl)propanamide CAS Name: 3-[4-(4-morpholinylsulfonyl)phenyl]-N-[2-(phenylmethylthio)phenyl]propanamide IUPAC Name: N-(2-benzylsulfanylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: N-[2-(benzylthio)phenyl]-3-(4-morpholinosulfonylphenyl)propionamide Formula: C26H28N2O4S2 MolecularWeight: 496.64152

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC=CC=C3SCC4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC=CC=C3SCC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O4S2/c29-26(27-24-8-4-5-9-25(24)33-20-22-6-2-1-3-7-22)15-12-21-10-13-23(14-11-21)34(30,31)28-16-18-32-19-17-28/h1-11,13-14H,12,15-20H2,(H,27,29)