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

Systemtic Name: [1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] 3-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 3-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [1-(3-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-cyanoanilino)-1-oxopropan-2-yl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 3-[(2-methylthiazol-4-yl)methoxy]benzoic acid [2-(3-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)OC(C)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)OC(C)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H19N3O4S/c1-14(21(26)25-18-7-3-5-16(9-18)11-23)29-22(27)17-6-4-8-20(10-17)28-12-19-13-30-15(2)24-19/h3-10,13-14H,12H2,1-2H3,(H,25,26)