ethyl 4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)methyl]benzoate

Systemtic Name: ethyl 4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)methyl]benzoate Openeye Name: ethyl 4-[(2-amino-4-oxo-thiazol-5-yl)methyl]benzoate CAS Name: 4-[(2-amino-4-oxo-5-thiazolyl)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-amino-4-oxo-1,3-thiazol-5-yl)methyl]benzoate Traditional Name: 4-[(2-amino-4-keto-2-thiazolin-5-yl)methyl]benzoic acid ethyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CC2C(=O)N=C(S2)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CC2C(=O)N=C(S2)N

InChI

InChI=1S/C13H14N2O3S/c1-2-18-12(17)9-5-3-8(4-6-9)7-10-11(16)15-13(14)19-10/h3-6,10H,2,7H2,1H3,(H2,14,15,16)