[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 2-[(2-methylthiazol-4-yl)methoxy]benzoic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=CC=C2C(=O)OCC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=CC=C2C(=O)OCC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H17N3O4S/c1-14-23-17(13-29-14)11-27-19-8-3-2-7-18(19)21(26)28-12-20(25)24-16-6-4-5-15(9-16)10-22/h2-9,13H,11-12H2,1H3,(H,24,25)