[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 2,4-diphenyl-1,3-thiazole-5-carboxylate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 2,4-diphenyl-1,3-thiazole-5-carboxylate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] 2,4-diphenylthiazole-5-carboxylate CAS Name: 2,4-diphenyl-5-thiazolecarboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 2,4-diphenyl-1,3-thiazole-5-carboxylate Traditional Name: 2,4-diphenylthiazole-5-carboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC(=O)C1=C(N=C(S1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CN(CCC#N)C(=O)COC(=O)C1=C(N=C(S1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H19N3O3S/c1-25(14-8-13-23)18(26)15-28-22(27)20-19(16-9-4-2-5-10-16)24-21(29-20)17-11-6-3-7-12-17/h2-7,9-12H,8,14-15H2,1H3