ethyl (3E)-3-azanyl-3-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)-2-cyano-propanoate

Systemtic Name: ethyl (3E)-3-azanyl-3-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)-2-cyano-propanoate Openeye Name: ethyl (3E)-3-amino-3-(2-amino-4-oxo-thiazol-5-ylidene)-2-cyano-propanoate CAS Name: (3E)-3-amino-3-(2-amino-4-oxo-5-thiazolylidene)-2-cyanopropanoic acid ethyl ester IUPAC Name: ethyl (3E)-3-amino-3-(2-amino-4-oxo-1,3-thiazol-5-ylidene)-2-cyanopropanoate Traditional Name: (3E)-3-amino-3-(2-amino-4-keto-2-thiazolin-5-ylidene)-2-cyano-propionic acid ethyl ester Formula: C9H10N4O3S MolecularWeight: 254.2657

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=C1C(=O)N=C(S1)N)N

Isomeric SMILES

CCOC(=O)C(C#N)/C(=C\1/C(=O)N=C(S1)N)/N

InChI

InChI=1S/C9H10N4O3S/c1-2-16-8(15)4(3-10)5(11)6-7(14)13-9(12)17-6/h4H,2,11H2,1H3,(H2,12,13,14)/b6-5+