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

Systemtic Name: ethyl (E)-2-cyano-3-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[(5-isobutyl-1,3,4-thiadiazol-2-yl)amino]prop-2-enoate CAS Name: (E)-2-cyano-3-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]amino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[(5-isobutyl-1,3,4-thiadiazol-2-yl)amino]acrylic acid ethyl ester Formula: C12H16N4O2S MolecularWeight: 280.34604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4O2S/c1-4-18-11(17)9(6-13)7-14-12-16-15-10(19-12)5-8(2)3/h7-8H,4-5H2,1-3H3,(H,14,16)/b9-7+