[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(4-fluorophenyl)-4-methyl-5-thiazolecarboxylic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxylic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C18H12FN3O3S2 MolecularWeight: 401.434583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)OCC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)OCC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C18H12FN3O3S2/c1-10-15(27-17(21-10)11-2-4-13(19)5-3-11)18(24)25-9-14(23)22-16-12(8-20)6-7-26-16/h2-7H,9H2,1H3,(H,22,23)