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

Systemtic Name: ethyl (E)-2-cyano-3-[[5-(phenylmethyl)-1,3-thiazol-2-yl]amino]prop-2-enoate Openeye Name: ethyl (E)-3-[(5-benzylthiazol-2-yl)amino]-2-cyano-prop-2-enoate CAS Name: (E)-2-cyano-3-[[5-(phenylmethyl)-2-thiazolyl]amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(5-benzyl-1,3-thiazol-2-yl)amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[(5-benzylthiazol-2-yl)amino]-2-cyano-acrylic acid ethyl ester Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O2S/c1-2-21-15(20)13(9-17)10-18-16-19-11-14(22-16)8-12-6-4-3-5-7-12/h3-7,10-11H,2,8H2,1H3,(H,18,19)/b13-10+