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

Systemtic Name: (E)-2-cyano-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(2-methylthiazol-4-yl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(2-methyl-4-thiazolyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(2-methylthiazol-4-yl)acrylic acid Formula: C8H6N2O2S MolecularWeight: 194.21044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=C(C#N)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C8H6N2O2S/c1-5-10-7(4-13-5)2-6(3-9)8(11)12/h2,4H,1H3,(H,11,12)/b6-2+