(E)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enamide CAS Name: (E)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-(4-methoxy-3-morpholinosulfonyl-phenyl)acrylamide Formula: C18H22N4O5S3 MolecularWeight: 470.58608

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)/C=C/C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H22N4O5S3/c1-3-28-18-21-20-17(29-18)19-16(23)7-5-13-4-6-14(26-2)15(12-13)30(24,25)22-8-10-27-11-9-22/h4-7,12H,3,8-11H2,1-2H3,(H,19,20,23)/b7-5+