ethyl (E)-2-cyano-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]prop-2-enoate CAS Name: (E)-2-cyano-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]prop-2-enoate Traditional Name: (E)-3-[(5-amyl-1,3,4-thiadiazol-2-yl)amino]-2-cyano-acrylic acid ethyl ester Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC=C(C#N)C(=O)OCC

Isomeric SMILES

CCCCCC1=NN=C(S1)N/C=C(\C#N)/C(=O)OCC

InChI

InChI=1S/C13H18N4O2S/c1-3-5-6-7-11-16-17-13(20-11)15-9-10(8-14)12(18)19-4-2/h9H,3-7H2,1-2H3,(H,15,17)/b10-9+