2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(4-methoxy-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-2-(4-methoxy-3-morpholinosulfonyl-phenyl)acetamide Formula: C18H22N4O5S3 MolecularWeight: 470.58608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2=NN=C(S2)SCC=C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2=NN=C(S2)SCC=C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H22N4O5S3/c1-3-10-28-18-21-20-17(29-18)19-16(23)12-13-4-5-14(26-2)15(11-13)30(24,25)22-6-8-27-9-7-22/h3-5,11H,1,6-10,12H2,2H3,(H,19,20,23)