3-methylsulfanyl-2-[2-morpholin-4-ylethyl-(4-phenoxyphenyl)sulfonyl-amino]propanamide

Systemtic Name: 3-methylsulfanyl-2-[2-morpholin-4-ylethyl-(4-phenoxyphenyl)sulfonyl-amino]propanamide Openeye Name: 3-methylsulfanyl-2-[2-morpholinoethyl-(4-phenoxyphenyl)sulfonyl-amino]propanamide CAS Name: 3-(methylthio)-2-[2-(4-morpholinyl)ethyl-(4-phenoxyphenyl)sulfonylamino]propanamide IUPAC Name: 3-methylsulfanyl-2-[2-morpholin-4-ylethyl-(4-phenoxyphenyl)sulfonylamino]propanamide Traditional Name: 3-(methylthio)-2-[2-morpholinoethyl-(4-phenoxyphenyl)sulfonyl-amino]propionamide Formula: C22H29N3O5S2 MolecularWeight: 479.61276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)N)N(CCN1CCOCC1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CSCC(C(=O)N)N(CCN1CCOCC1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O5S2/c1-31-17-21(22(23)26)25(12-11-24-13-15-29-16-14-24)32(27,28)20-9-7-19(8-10-20)30-18-5-3-2-4-6-18/h2-10,21H,11-17H2,1H3,(H2,23,26)