3-methylbut-2-enyl 3-azanyl-2-pyridin-2-yl-3-sulfanylidene-propanoate

Systemtic Name: 3-methylbut-2-enyl 3-azanyl-2-pyridin-2-yl-3-sulfanylidene-propanoate Openeye Name: 3-methylbut-2-enyl 3-amino-2-(2-pyridyl)-3-thioxo-propanoate CAS Name: 3-amino-2-(2-pyridinyl)-3-sulfanylidenepropanoic acid 3-methylbut-2-enyl ester IUPAC Name: 3-methylbut-2-enyl 3-amino-2-pyridin-2-yl-3-sulfanylidenepropanoate Traditional Name: 3-amino-2-(2-pyridyl)-3-thioxo-propionic acid 3-methylbut-2-enyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C(C1=CC=CC=N1)C(=S)N)C

Isomeric SMILES

CC(=CCOC(=O)C(C1=CC=CC=N1)C(=S)N)C

InChI

InChI=1S/C13H16N2O2S/c1-9(2)6-8-17-13(16)11(12(14)18)10-5-3-4-7-15-10/h3-7,11H,8H2,1-2H3,(H2,14,18)