ethyl (E)-2-cyano-3-[[4-(pyrrolidin-1-ylmethyl)-1,3-thiazol-2-yl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[4-(pyrrolidin-1-ylmethyl)-1,3-thiazol-2-yl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[[4-(pyrrolidin-1-ylmethyl)thiazol-2-yl]amino]prop-2-enoate CAS Name: (E)-2-cyano-3-[[4-(1-pyrrolidinylmethyl)-2-thiazolyl]amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[[4-(pyrrolidin-1-ylmethyl)-1,3-thiazol-2-yl]amino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[[4-(pyrrolidinomethyl)thiazol-2-yl]amino]acrylic acid ethyl ester Formula: C14H18N4O2S MolecularWeight: 306.38332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC(=CS1)CN2CCCC2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=NC(=CS1)CN2CCCC2)/C#N

InChI

InChI=1S/C14H18N4O2S/c1-2-20-13(19)11(7-15)8-16-14-17-12(10-21-14)9-18-5-3-4-6-18/h8,10H,2-6,9H2,1H3,(H,16,17)/b11-8+