ethyl 2-[2-[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl]sulfanyl-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl]sulfanyl-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(E)-4-amino-3-cyano-2-oxo-pent-3-enyl]sulfanylthiazol-4-yl]acetate CAS Name: 2-[2-[[(E)-4-amino-3-cyano-2-oxopent-3-enyl]thio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(E)-4-amino-3-cyano-2-oxopent-3-enyl]sulfanyl-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[(E)-4-amino-3-cyano-2-keto-pent-3-enyl]thio]thiazol-4-yl]acetic acid ethyl ester Formula: C13H15N3O3S2 MolecularWeight: 325.4065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC(=O)C(=C(C)N)C#N

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC(=O)/C(=C(\C)/N)/C#N

InChI

InChI=1S/C13H15N3O3S2/c1-3-19-12(18)4-9-6-20-13(16-9)21-7-11(17)10(5-14)8(2)15/h6H,3-4,7,15H2,1-2H3/b10-8+