ethyl 4-[2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[4-(4-phenylthiazol-2-yl)piperazin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[4-(4-phenyl-2-thiazolyl)-1-piperazinyl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(4-phenylthiazol-2-yl)piperazino]acetyl]amino]benzoic acid ethyl ester Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N4O3S/c1-2-31-23(30)19-8-10-20(11-9-19)25-22(29)16-27-12-14-28(15-13-27)24-26-21(17-32-24)18-6-4-3-5-7-18/h3-11,17H,2,12-16H2,1H3,(H,25,29)