ethyl 2-(4-methyl-3H-1,3-thiazol-2-ylidene)-3-oxidanylidene-4-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanoate

Systemtic Name: ethyl 2-(4-methyl-3H-1,3-thiazol-2-ylidene)-3-oxidanylidene-4-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanoate Openeye Name: ethyl 2-(4-methyl-3H-thiazol-2-ylidene)-3-oxo-4-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanoate CAS Name: 2-(4-methyl-3H-thiazol-2-ylidene)-3-oxo-4-[(4-phenyl-1,2,4-triazol-3-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 2-(4-methyl-3H-1,3-thiazol-2-ylidene)-3-oxo-4-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanoate Traditional Name: 3-keto-2-(4-methyl-4-thiazolin-2-ylidene)-4-[(4-phenyl-1,2,4-triazol-3-yl)thio]butyric acid ethyl ester Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1NC(=CS1)C)C(=O)CSC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(=C1NC(=CS1)C)C(=O)CSC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O3S2/c1-3-25-17(24)15(16-20-12(2)9-26-16)14(23)10-27-18-21-19-11-22(18)13-7-5-4-6-8-13/h4-9,11,20H,3,10H2,1-2H3