(E)-2-cyano-3-(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(4-methyl-2-morpholino-thiazol-5-yl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-[4-methyl-2-(4-morpholinyl)-5-thiazolyl]-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(4-methyl-2-morpholino-thiazol-5-yl)acrylic acid Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2CCOCC2)C=C(C#N)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)N2CCOCC2)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C12H13N3O3S/c1-8-10(6-9(7-13)11(16)17)19-12(14-8)15-2-4-18-5-3-15/h6H,2-5H2,1H3,(H,16,17)/b9-6+