[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-acetamido-1,3-thiazole-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-acetamido-1,3-thiazole-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-acetamidothiazole-4-carboxylate CAS Name: 2-acetamido-4-thiazolecarboxylic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-acetamido-1,3-thiazole-4-carboxylate Traditional Name: 2-acetamidothiazole-4-carboxylic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CSC(=N3)NC(=O)C

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CSC(=N3)NC(=O)C

InChI

InChI=1S/C19H22N4O4S/c1-13(27-18(26)16-12-28-19(21-16)20-14(2)24)17(25)23-10-8-22(9-11-23)15-6-4-3-5-7-15/h3-7,12-13H,8-11H2,1-2H3,(H,20,21,24)