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

Systemtic Name: ethyl (E)-2-cyano-3-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]amino]prop-2-enoate Openeye Name: ethyl (E)-3-[(5-benzyl-1,3,4-thiadiazol-2-yl)amino]-2-cyano-prop-2-enoate CAS Name: (E)-2-cyano-3-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(5-benzyl-1,3,4-thiadiazol-2-yl)amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[(5-benzyl-1,3,4-thiadiazol-2-yl)amino]-2-cyano-acrylic acid ethyl ester Formula: C15H14N4O2S MolecularWeight: 314.36226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NN=C(S1)CC2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=NN=C(S1)CC2=CC=CC=C2)/C#N

InChI

InChI=1S/C15H14N4O2S/c1-2-21-14(20)12(9-16)10-17-15-19-18-13(22-15)8-11-6-4-3-5-7-11/h3-7,10H,2,8H2,1H3,(H,17,19)/b12-10+