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

Systemtic Name: (E)-2-cyano-3-(4-methyl-2-piperidin-1-yl-1,3-thiazol-5-yl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-[4-methyl-2-(1-piperidyl)thiazol-5-yl]prop-2-enoic acid CAS Name: (E)-2-cyano-3-[4-methyl-2-(1-piperidinyl)-5-thiazolyl]-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(4-methyl-2-piperidin-1-yl-1,3-thiazol-5-yl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(4-methyl-2-piperidino-thiazol-5-yl)acrylic acid Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2CCCCC2)C=C(C#N)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)N2CCCCC2)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C13H15N3O2S/c1-9-11(7-10(8-14)12(17)18)19-13(15-9)16-5-3-2-4-6-16/h7H,2-6H2,1H3,(H,17,18)/b10-7+