[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=CSC(=N1)NCC=C)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=CSC(=N1)NCC=C)/N

InChI

InChI=1S/C13H14N4O3S/c1-3-4-16-13-17-10(7-21-13)12(19)20-6-11(18)9(5-14)8(2)15/h3,7H,1,4,6,15H2,2H3,(H,16,17)/b9-8+