N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(3-phenylpropylsulfanyl)ethanamide

Systemtic Name: N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(3-phenylpropylsulfanyl)ethanamide Openeye Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-(3-phenylpropylsulfanyl)acetamide CAS Name: N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-2-(3-phenylpropylthio)acetamide IUPAC Name: N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-2-(3-phenylpropylsulfanyl)acetamide Traditional Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-(3-phenylpropylthio)acetamide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSCCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSCCCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O4S2/c1-18-9-10-20(30(26,27)24-11-13-28-14-12-24)16-21(18)23-22(25)17-29-15-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-10,16H,5,8,11-15,17H2,1H3,(H,23,25)