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

Systemtic Name: ethyl (E)-3-[[4-(5-bromanylthiophen-2-yl)-1,3-thiazol-2-yl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[[4-(5-bromo-2-thienyl)thiazol-2-yl]amino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[[4-(5-bromo-2-thiophenyl)-2-thiazolyl]amino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[[4-(5-bromo-2-thienyl)thiazol-2-yl]amino]-2-cyano-acrylic acid ethyl ester Formula: C13H10BrN3O2S2 MolecularWeight: 384.2714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC(=CS1)C2=CC=C(S2)Br)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=NC(=CS1)C2=CC=C(S2)Br)/C#N

InChI

InChI=1S/C13H10BrN3O2S2/c1-2-19-12(18)8(5-15)6-16-13-17-9(7-20-13)10-3-4-11(14)21-10/h3-4,6-7H,2H2,1H3,(H,16,17)/b8-6+