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

Systemtic Name: propyl 4-[2-(2-phenyl-1,3-thiazol-4-yl)ethanoylamino]benzoate Openeye Name: propyl 4-[[2-(2-phenylthiazol-4-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-(2-phenyl-4-thiazolyl)ethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(2-phenyl-1,3-thiazol-4-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-phenylthiazol-4-yl)acetyl]amino]benzoic acid propyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-2-12-26-21(25)16-8-10-17(11-9-16)22-19(24)13-18-14-27-20(23-18)15-6-4-3-5-7-15/h3-11,14H,2,12-13H2,1H3,(H,22,24)